A0A3Q0KNQ3_SCHMA Loading...

Putative leucine rich repeat-containing

AlphaFold DB , UniProt , Accession A0A3Q0KNQ3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 546 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.8	Very low	42.9	Very low	249 Å²	249	159.6 Å²	159.6	100%	1.227	88%	0.88	S	S	*	*				0	127.5	0	-70	-172.6	-169.6	0	0	109.5
2	G	40.5	Very low	42.2	Very low	82 Å²	82	163.3 Å²	163.3	85%	0.845	88%	0.88	S	S	*	*			trans	35.5	106.6	160.4	0	0	0	0	0	121.9
3	K	42.7	Very low	42.2	Very low	216 Å²	216	161.4 Å²	161.4	94%	0.939	88%	0.877	S	S	*	*			trans	-109.6	127.1	149.3	-80.9	-173	176.3	-179.3	0	109.7
4	K	42.6	Very low	41.7	Very low	207 Å²	207	154.4 Å²	154.4	90%	0.9	86%	0.861	S	S	*	*			trans	-104.5	121	172.3	-88.2	-176.9	176	176.9	0	110.6
5	S	40.8	Very low	41	Very low	113 Å²	113	154.8 Å²	154.8	79%	0.79	86%	0.861	S	S	*	*			trans	26.7	128.5	135.9	64.2	0	0	0	0	122.7
6	A	51.1	Low	40.6	Very low	99 Å²	99	154.4 Å²	154.4	82%	0.818	86%	0.855	S	S	*	*			trans	-143.6	102	136	0	0	0	0	0	107
7	K	41.2	Very low	40.1	Very low	205 Å²	205	155.6 Å²	155.6	89%	0.891	85%	0.853	S	S	*	*				57.8	97.5	101.3	-93.7	-175.6	-180	173.2	0	114.2
8	D	48.9	Very low	39.9	Very low	172 Å²	172	153.7 Å²	153.7	92%	0.92	84%	0.84	S	S	*	*			trans	-133.4	138.8	155.1	-142.7	-13.1	0	0	0	110
9	K	45	Very low	39.4	Very low	182 Å²	182	152.5 Å²	152.5	79%	0.791	84%	0.838	S	S	*	*			trans	-115.3	113.5	-168.5	-86.2	-178	174.2	-179.8	0	111.2
10	S	40.4	Very low	39.5	Very low	108 Å²	108	149.4 Å²	149.4	76%	0.755	83%	0.827	S	S	*	*			trans	66.5	147	141.8	-40.2	0	0	0	0	119.5
11	P	37	Very low	39.6	Very low	123 Å²	123	149 Å²	149	80%	0.799	82%	0.824	S	S	*	*				-130.2	156.3	74.7	35	-21.5	0	0	0	115.1
12	K	34.7	Very low	39.8	Very low	204 Å²	204	142.7 Å²	142.7	89%	0.887	80%	0.802	S	S	*	*			trans	-66.2	127.5	171.1	-67.1	171.9	174.2	179.2	0	109.9
13	V	41.8	Very low	40.5	Very low	138 Å²	138	147.9 Å²	147.9	84%	0.836	80%	0.801	S	S	*	*			trans	-123.5	114	157.7	179	0	0	0	0	105.8
14	G	35.7	Very low	42	Very low	63 Å²	63	143.5 Å²	143.5	65%	0.649	79%	0.788	S	S	*	*			trans	-68.7	145.1	-177.8	0	0	0	0	0	111.8	L16	G14-L16 PolarHBondContact O-N 3Å
15	D	30.2	Very low	43.7	Very low	161 Å²	161	136.8 Å²	136.8	86%	0.861	76%	0.757	S	S	*	*			trans	-52.2	115.6	169.8	-61.4	-57	0	0	0	111.1
16	L	35.7	Very low	45.7	Very low	148 Å²	148	137 Å²	137	78%	0.775	75%	0.753	S	S	*	*			trans	-131.9	77.6	159.9	-89	162.6	0	0	0	107.5	G14 I18	G14-L16 PolarHBondContact O-N 3Å; L16-I18 VanDerWaalsContact C-N 3.27Å; L16-I18 HydrophobicContact CB-CG1 4.42Å; L16-I18 HydrophobicContact CD2-CD1 4.25Å; L16-I18 HydrophobicContact CD2-CG1 4.11Å; L16-I18 PolarHBondContact O-N 3.25Å
17	H	31.9	Very low	47.2	Very low	175 Å²	175	134.5 Å²	134.5	81%	0.81	73%	0.728	S	S	*	*			trans	-62.4	94.5	152.2	-91.3	-58.1	0	0	0	107.8
18	I	36.5	Very low	49.2	Very low	122 Å²	122	129 Å²	129	63%	0.626	71%	0.712	S	S	*	*			trans	-98.9	79.6	161.5	-55.6	177	0	0	0	106.8	L16 S20	L16-I18 VanDerWaalsContact C-N 3.27Å; L16-I18 HydrophobicContact CB-CG1 4.42Å; L16-I18 HydrophobicContact CD2-CD1 4.25Å; L16-I18 HydrophobicContact CD2-CG1 4.11Å; L16-I18 PolarHBondContact O-N 3.25Å; I18-S20 VanDerWaalsContact C-N 3.3Å; I18-S20 PolarHBondContact O-N 3.03Å
19	T	30.3	Very low	50.6	Low	130 Å²	130	121.7 Å²	121.7	80%	0.798	68%	0.677	S	S	*	*			trans	-81.7	85.8	151.4	51.8	0	0	0	0	106.2
20	S	41.2	Very low	52.5	Low	90 Å²	90	114.6 Å²	114.6	63%	0.629	65%	0.648	S	S	*	*			trans	-98.6	111.9	166.4	60.3	0	0	0	0	107.6	I18	I18-S20 VanDerWaalsContact C-N 3.3Å; I18-S20 PolarHBondContact O-N 3.03Å
21	D	41.3	Very low	54.7	Low	142 Å²	142	109.7 Å²	109.7	76%	0.759	61%	0.613	S	S	*	*			trans	-42.3	140.8	159.7	-76.6	-44.6	0	0	0	109.4	K23	D21-K23 PolarHBondContact O-N 3.48Å
22	P	46.3	Very low	57	Low	117 Å²	117	108.2 Å²	108.2	76%	0.76	60%	0.596	S	S	*	*			trans	-69.6	83.5	172.7	30.2	-30.3	0	0	0	107.5	D24	P22-D24 PolarHBondContact O-N 3.03Å
23	K	56	Low	59.5	Low	191 Å²	191	102.5 Å²	102.5	83%	0.83	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-54.8	125	164.2	-73.4	-174.1	178.1	-178.7	0	106.5	D21 Y25	D21-K23 PolarHBondContact O-N 3.48Å; K23-Y25 PolarHBondContact O-N 2.99Å
24	D	72.4	Confident	61.7	Low	123 Å²	123	96 Å²	96	66%	0.658	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-47.3	129.9	-179.2	-67	-49	0	0	0	110.5	P22 V26 Q41	P22-D24 PolarHBondContact O-N 3.03Å; D24-V26 PolarHBondContact O-N 3.26Å; D24-Q41 PolarHBondContact OD1-NE2 3.13Å
25	Y	80.3	Confident	64.2	Low	66 Å²	66	93.1 Å²	93.1	26%	0.259	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-65.9	124.6	178.5	176.8	-90.7	0	0	0	108.9	K23 N33 D34 L38 Q41	K23-Y25 PolarHBondContact O-N 2.99Å; Y25-N33 PolarHBondContact OH-O 2.72Å; Y25-D34 HydrophobicContact CE1-CB 4.34Å; Y25-D34 WeakPolarHBondContact OH-CA 3.46Å; Y25-D34 PolarHBondContact OH-N 2.79Å; Y25-D34 PolarHBondContact OH-OD1 3.41Å; Y25-D34 VanDerWaalsContact OH-OD1 3.11Å; Y25-L38 HydrophobicContact CD1-CD2 4.07Å; Y25-L38 HydrophobicContact CD1-CG 3.94Å; Y25-L38 HydrophobicContact CE1-CG 4.41Å; Y25-Q41 VanDerWaalsContact CB-OE1 3.31Å
26	V	82.5	Confident	66.9	Low	117 Å²	117	91.5 Å²	91.5	71%	0.709	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-85.7	118.4	178.1	-178.5	0	0	0	0	108.7	D24 T28	D24-V26 PolarHBondContact O-N 3.26Å; V26-T28 WeakPolarHBondContact O-CG2 3.28Å; V26-T28 PolarHBondContact O-N 2.73Å
27	V	82.2	Confident	69.4	Low	48 Å²	48	85 Å²	85	29%	0.291	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-65.3	124.4	178.7	-168.3	0	0	0	0	109.8	D34 L38 V154	V27-D34 HydrophobicContact CG1-CB 4.08Å; V27-D34 VanDerWaalsContact CG1-CG 3.48Å; V27-D34 WeakPolarHBondContact CG1-OD2 3.48Å; V27-L38 HydrophobicContact CG2-CD1 4.11Å; V27-L38 HydrophobicContact CG2-CD2 4.18Å; V27-L38 HydrophobicContact CG2-CG 4.46Å; V27-V154 HydrophobicContact CB-CG2 4.21Å; V27-V154 HydrophobicContact CG1-CB 3.95Å; V27-V154 HydrophobicContact CG1-CG1 4.17Å; V27-V154 HydrophobicContact CG1-CG2 3.55Å
28	T	83	Confident	72	Confident	88 Å²	88	76.9 Å²	76.9	54%	0.54	42%	0.423	S	S	.	.			trans	-96.9	-17	-171	63.9	0	0	0	0	113.7	V26 N30 D34	V26-T28 WeakPolarHBondContact O-CG2 3.28Å; V26-T28 PolarHBondContact O-N 2.73Å; T28-N30 VanDerWaalsContact C-N 3.28Å; T28-N30 PolarHBondContact OG1-N 3.09Å; T28-D34 WeakPolarHBondContact CB-OD1 3.49Å; T28-D34 PolarHBondContact N-OD1 3.38Å; T28-D34 PolarHBondContact N-OD2 3.32Å; T28-D34 PolarHBondContact OG1-OD1 3.38Å
29	G	79.3	Confident	74.5	Confident	19 Å²	19	71.2 Å²	71.2	20%	0.196	39%	0.394	C	S	.	.	S	Bend	trans	86.6	-5.9	-170.3	0	0	0	0	0	113.5	D34	G29-D34 VanDerWaalsContact CA-OD2 3.28Å; G29-D34 WeakPolarHBondContact CA-OD2 3.45Å; G29-D34 PolarHBondContact N-OD2 3.38Å
30	N	84.9	Confident	77.2	Confident	33 Å²	33	73.2 Å²	73.2	18%	0.176	39%	0.392	C	S	.	.			trans	-89.6	105.4	169.3	-178.7	-20.8	0	0	0	109.2	T28 E32 N33 D34 P127	T28-N30 VanDerWaalsContact C-N 3.28Å; T28-N30 PolarHBondContact OG1-N 3.09Å; N30-E32 PolarHBondContact O-N 3.26Å; N30-E32 VanDerWaalsContact O-N 3.1Å; N30-E32 WeakPolarHBondContact OD1-CB 3.5Å; N30-E32 PolarHBondContact OD1-N 3.15Å; N30-E32 VanDerWaalsContact OD1-N 3.07Å; N30-N33 HydrophobicContact CB-CB 4.29Å; N30-N33 PolarHBondContact ND2-ND2 3.4Å; N30-N33 PolarHBondContact O-N 2.67Å; N30-N33 VanDerWaalsContact O-N 3.1Å; N30-D34 PolarHBondContact N-OD2 3.25Å; N30-D34 VanDerWaalsContact O-CB 3.32Å; N30-D34 WeakPolarHBondContact O-CB 3.33Å; N30-D34 PolarHBondContact O-N 3.03Å; N30-P127 HydrophobicContact CB-CB 4.07Å; N30-P127 HydrophobicContact CB-CG 4.44Å
31	L	86.1	Confident	79.3	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-53.2	-35.8	-176.2	-159.5	90.5	0	0	0	113.6	F35 V50 I119 V133 C151 F152	L31-F35 WeakPolarHBondContact O-CB 3.46Å; L31-F35 PolarHBondContact O-N 3.04Å; L31-V50 HydrophobicContact CD2-CG1 4.48Å; L31-I119 HydrophobicContact CD2-CG2 3.39Å; L31-V133 HydrophobicContact CD2-CG1 4.36Å; L31-V133 HydrophobicContact CD2-CG2 3.61Å; L31-C151 HydrophobicContact CD1-CB 3.56Å; L31-C151 HydrophobicContact CG-CB 4.42Å; L31-F152 HydrophobicContact CD1-CD1 4.18Å; L31-F152 HydrophobicContact CD1-CE1 4.41Å
32	E	85.1	Confident	81.3	Confident	93 Å²	93	68.2 Å²	68.2	44%	0.435	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-49.7	179.7	177.2	173.7	-173.2	0	0	111.4	N30 H36 V50	N30-E32 PolarHBondContact O-N 3.26Å; N30-E32 VanDerWaalsContact O-N 3.1Å; N30-E32 WeakPolarHBondContact OD1-CB 3.5Å; N30-E32 PolarHBondContact OD1-N 3.15Å; N30-E32 VanDerWaalsContact OD1-N 3.07Å; E32-H36 PolarHBondContact O-N 3.32Å; E32-V50 HydrophobicContact CB-CB 4.09Å; E32-V50 HydrophobicContact CB-CG1 4.13Å; E32-V50 HydrophobicContact CG-CB 4.13Å
33	N	86.1	Confident	83.1	Confident	83 Å²	83	65.4 Å²	65.4	44%	0.444	35%	0.352	S	S	.	.	H	α-helix	trans	-69	-43.8	178.9	-67.9	-23.8	0	0	0	111.1	Y25 N30 H36 G37	Y25-N33 PolarHBondContact OH-O 2.72Å; N30-N33 HydrophobicContact CB-CB 4.29Å; N30-N33 PolarHBondContact ND2-ND2 3.4Å; N30-N33 PolarHBondContact O-N 2.67Å; N30-N33 VanDerWaalsContact O-N 3.1Å; N33-H36 PolarHBondContact O-N 3.11Å; N33-G37 PolarHBondContact O-N 3.31Å
34	D	88.8	Confident	84.4	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-65.1	-44.1	-174.6	-67.2	-17.6	0	0	0	111.2	Y25 V27 T28 G29 N30 H36 G37 L38	Y25-D34 HydrophobicContact CE1-CB 4.34Å; Y25-D34 WeakPolarHBondContact OH-CA 3.46Å; Y25-D34 PolarHBondContact OH-N 2.79Å; Y25-D34 PolarHBondContact OH-OD1 3.41Å; Y25-D34 VanDerWaalsContact OH-OD1 3.11Å; V27-D34 HydrophobicContact CG1-CB 4.08Å; V27-D34 VanDerWaalsContact CG1-CG 3.48Å; V27-D34 WeakPolarHBondContact CG1-OD2 3.48Å; T28-D34 WeakPolarHBondContact CB-OD1 3.49Å; T28-D34 PolarHBondContact N-OD1 3.38Å; T28-D34 PolarHBondContact N-OD2 3.32Å; T28-D34 PolarHBondContact OG1-OD1 3.38Å; G29-D34 VanDerWaalsContact CA-OD2 3.28Å; G29-D34 WeakPolarHBondContact CA-OD2 3.45Å; G29-D34 PolarHBondContact N-OD2 3.38Å; N30-D34 PolarHBondContact N-OD2 3.25Å; N30-D34 VanDerWaalsContact O-CB 3.32Å; N30-D34 WeakPolarHBondContact O-CB 3.33Å; N30-D34 PolarHBondContact O-N 3.03Å; D34-H36 PolarHBondContact O-N 2.74Å; D34-G37 PolarHBondContact O-N 3.07Å; D34-L38 WeakPolarHBondContact O-CB 3.2Å; D34-L38 VanDerWaalsContact O-CG 3.23Å; D34-L38 WeakPolarHBondContact O-CG 3.34Å; D34-L38 PolarHBondContact O-N 2.9Å
35	F	88.5	Confident	84.6	Confident	3 Å²	3	57 Å²	57	1%	0.013	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-47.8	178.1	-179	-109.2	0	0	0	111.3	L31 C39 C47 P48 V50 I117 W138 V147 L148	L31-F35 WeakPolarHBondContact O-CB 3.46Å; L31-F35 PolarHBondContact O-N 3.04Å; F35-C39 WeakPolarHBondContact O-CB 3.47Å; F35-C39 PolarHBondContact O-N 3.21Å; F35-C39 PolarHBondContact O-SG 2.95Å; F35-C39 VanDerWaalsContact O-SG 3.35Å; F35-C47 HydrophobicContact CE1-CB 3.75Å; F35-C47 HydrophobicContact CZ-CB 4.2Å; F35-P48 HydrophobicContact CE1-CG 4.04Å; F35-P48 HydrophobicContact CZ-CG 4.25Å; F35-V50 HydrophobicContact CB-CG2 4.2Å; F35-V50 HydrophobicContact CD1-CG2 3.8Å; F35-V50 HydrophobicContact CG-CG2 4.28Å; F35-I117 HydrophobicContact CD1-CD1 3.79Å; F35-I117 HydrophobicContact CD2-CD1 4.11Å; F35-I117 HydrophobicContact CE1-CD1 3.46Å; F35-I117 VanDerWaalsContact CE1-CD1 3.46Å; F35-I117 HydrophobicContact CE2-CD1 3.85Å; F35-I117 HydrophobicContact CG-CD1 4.1Å; F35-I117 HydrophobicContact CZ-CD1 3.51Å; F35-W138 AromaticContact CZ-CH2 3.81Å; F35-W138 HydrophobicContact CZ-CH2 3.81Å; F35-W138 HydrophobicContact CZ-CZ3 4.2Å; F35-V147 HydrophobicContact CD2-CG1 3.73Å; F35-V147 HydrophobicContact CE2-CG1 3.96Å; F35-L148 HydrophobicContact CD2-CD2 3.71Å; F35-L148 HydrophobicContact CD2-CG 4.34Å; F35-L148 HydrophobicContact CE2-CD2 3.58Å; F35-L148 HydrophobicContact CE2-CG 3.92Å
36	H	87.5	Confident	84.4	Confident	128 Å²	128	60.9 Å²	60.9	59%	0.593	34%	0.341	S	S	*	.	H	α-helix	trans	-67.1	-42.3	179.4	-176.5	-90.7	0	0	0	112.3	E32 N33 D34 C39 K40	E32-H36 PolarHBondContact O-N 3.32Å; N33-H36 PolarHBondContact O-N 3.11Å; D34-H36 PolarHBondContact O-N 2.74Å; H36-C39 WeakPolarHBondContact O-CB 3.32Å; H36-K40 PolarHBondContact O-N 3.15Å; H36-K40 VanDerWaalsContact O-N 3.11Å
37	G	86.6	Confident	84.2	Confident	11 Å²	11	57.3 Å²	57.3	11%	0.113	32%	0.321	C	S	.	.	H	α-helix	trans	-62.4	-48.7	177.9	0	0	0	0	0	112.8	N33 D34 K40 Q41	N33-G37 PolarHBondContact O-N 3.31Å; D34-G37 PolarHBondContact O-N 3.07Å; G37-K40 PolarHBondContact O-N 3.27Å; G37-Q41 PolarHBondContact O-N 3.21Å
38	L	87.9	Confident	84.2	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-70.1	-34.3	178.8	-70.7	171.6	0	0	0	112.7	Y25 V27 D34 K40 Q41 S42 V147 K150	Y25-L38 HydrophobicContact CD1-CD2 4.07Å; Y25-L38 HydrophobicContact CD1-CG 3.94Å; Y25-L38 HydrophobicContact CE1-CG 4.41Å; V27-L38 HydrophobicContact CG2-CD1 4.11Å; V27-L38 HydrophobicContact CG2-CD2 4.18Å; V27-L38 HydrophobicContact CG2-CG 4.46Å; D34-L38 WeakPolarHBondContact O-CB 3.2Å; D34-L38 VanDerWaalsContact O-CG 3.23Å; D34-L38 WeakPolarHBondContact O-CG 3.34Å; D34-L38 PolarHBondContact O-N 2.9Å; L38-K40 VanDerWaalsContact C-N 3.33Å; L38-Q41 PolarHBondContact O-N 2.93Å; L38-S42 VanDerWaalsContact O-CB 3.3Å; L38-S42 WeakPolarHBondContact O-CB 3.35Å; L38-S42 PolarHBondContact O-N 3.09Å; L38-S42 PolarHBondContact O-OG 3.1Å; L38-V147 HydrophobicContact CB-CB 4.45Å; L38-V147 HydrophobicContact CB-CG1 3.65Å; L38-V147 HydrophobicContact CB-CG2 4.23Å; L38-K150 HydrophobicContact CD1-CB 3.81Å; L38-K150 HydrophobicContact CD2-CD 4.4Å
39	C	87.7	Confident	84.2	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-54.7	-50.6	169.2	-94.8	0	0	0	0	110.9	F35 H36 Q41 S42 G43 V44 C47	F35-C39 WeakPolarHBondContact O-CB 3.47Å; F35-C39 PolarHBondContact O-N 3.21Å; F35-C39 PolarHBondContact O-SG 2.95Å; F35-C39 VanDerWaalsContact O-SG 3.35Å; H36-C39 WeakPolarHBondContact O-CB 3.32Å; C39-Q41 VanDerWaalsContact C-N 3.35Å; C39-Q41 PolarHBondContact O-N 3.33Å; C39-S42 PolarHBondContact O-N 2.83Å; C39-G43 PolarHBondContact O-N 3.11Å; C39-G43 VanDerWaalsContact O-N 3.16Å; C39-V44 HydrophobicContact CB-CB 4.21Å; C39-V44 PolarHBondContact O-N 3.29Å; C39-C47 HydrophobicContact CB-CB 4.1Å; C39-C47 WeakPolarHBondContact CB-SG 3.32Å; C39-C47 WeakPolarHBondContact SG-CB 3.44Å; C39-C47 CovalentContact SG-SG 2.05Å; C39-C47 PolarHBondContact SG-SG 2.86Å
40	K	87.5	Confident	84.5	Confident	172 Å²	172	55.9 Å²	55.9	75%	0.748	31%	0.309	S	S	*	.	H	α-helix	trans	-62.7	-41.2	-179.6	-171.1	179.4	179.9	-177.4	0	111.8	H36 G37 L38	H36-K40 PolarHBondContact O-N 3.15Å; H36-K40 VanDerWaalsContact O-N 3.11Å; G37-K40 PolarHBondContact O-N 3.27Å; L38-K40 VanDerWaalsContact C-N 3.33Å
41	Q	85	Confident	84.5	Confident	78 Å²	78	56.1 Å²	56.1	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-67.2	-36.1	177.1	-172.5	-179.2	-2.7	0	0	112.4	D24 Y25 G37 L38 C39 G43	D24-Q41 PolarHBondContact OD1-NE2 3.13Å; Y25-Q41 VanDerWaalsContact CB-OE1 3.31Å; G37-Q41 PolarHBondContact O-N 3.21Å; L38-Q41 PolarHBondContact O-N 2.93Å; C39-Q41 VanDerWaalsContact C-N 3.35Å; C39-Q41 PolarHBondContact O-N 3.33Å; Q41-G43 VanDerWaalsContact C-N 3.32Å; Q41-G43 PolarHBondContact O-N 3.35Å
42	S	84.6	Confident	84.3	Confident	49 Å²	49	58.7 Å²	58.7	34%	0.343	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	5	-176.6	-50.2	0	0	0	0	113.5	L38 C39 V44 V147	L38-S42 VanDerWaalsContact O-CB 3.3Å; L38-S42 WeakPolarHBondContact O-CB 3.35Å; L38-S42 PolarHBondContact O-N 3.09Å; L38-S42 PolarHBondContact O-OG 3.1Å; C39-S42 PolarHBondContact O-N 2.83Å; S42-V44 VanDerWaalsContact C-N 3.28Å; S42-V44 PolarHBondContact O-N 3.1Å; S42-V147 WeakPolarHBondContact OG-CG2 3.35Å
43	G	83.8	Confident	83.9	Confident	58 Å²	58	60.5 Å²	60.5	60%	0.598	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	19.3	-179.5	0	0	0	0	0	114.6	C39 Q41 T45	C39-G43 PolarHBondContact O-N 3.11Å; C39-G43 VanDerWaalsContact O-N 3.16Å; Q41-G43 VanDerWaalsContact C-N 3.32Å; Q41-G43 PolarHBondContact O-N 3.35Å; G43-T45 PolarHBondContact O-N 2.87Å
44	V	83	Confident	82.6	Confident	20 Å²	20	63.6 Å²	63.6	12%	0.121	35%	0.347	C	S	.	.			trans	-77.4	111.3	177.8	-177.4	0	0	0	0	109.1	C39 S42 C47 Q144 V147	C39-V44 HydrophobicContact CB-CB 4.21Å; C39-V44 PolarHBondContact O-N 3.29Å; S42-V44 VanDerWaalsContact C-N 3.28Å; S42-V44 PolarHBondContact O-N 3.1Å; V44-C47 WeakPolarHBondContact CG1-SG 3.37Å; V44-Q144 HydrophobicContact CG1-CG 3.5Å; V44-Q144 HydrophobicContact CG2-CG 4.36Å; V44-V147 HydrophobicContact CG2-CG2 4.44Å
45	T	77.2	Confident	80.5	Confident	118 Å²	118	68.1 Å²	68.1	72%	0.724	38%	0.379	S	S	*	.			trans	-83	-22.9	-172.9	54	0	0	0	0	114.4	G43	G43-T45 PolarHBondContact O-N 2.87Å
46	H	75.8	Confident	77.9	Confident	146 Å²	146	76.7 Å²	76.7	68%	0.676	42%	0.418	S	S	*	.			trans	-119.4	93.4	-177.1	-62.7	-58.9	0	0	0	110.3	Q144	H46-Q144 PolarHBondContact O-NE2 2.72Å; H46-Q144 VanDerWaalsContact O-NE2 3.12Å
47	C	77.7	Confident	75.3	Confident	43 Å²	43	74.2 Å²	74.2	29%	0.291	42%	0.42	S	S	.	.			trans	-112.8	122.3	178.2	-61.7	0	0	0	0	110.4	F35 C39 V44	F35-C47 HydrophobicContact CE1-CB 3.75Å; F35-C47 HydrophobicContact CZ-CB 4.2Å; C39-C47 HydrophobicContact CB-CB 4.1Å; C39-C47 WeakPolarHBondContact CB-SG 3.32Å; C39-C47 WeakPolarHBondContact SG-CB 3.44Å; C39-C47 CovalentContact SG-SG 2.05Å; C39-C47 PolarHBondContact SG-SG 2.86Å; V44-C47 WeakPolarHBondContact CG1-SG 3.37Å
48	P	83	Confident	72.6	Confident	16 Å²	16	81.1 Å²	81.1	10%	0.104	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-65.2	158.4	175.9	28.6	-38.1	0	0	0	111.2	F35 P115 I117 W138	F35-P48 HydrophobicContact CE1-CG 4.04Å; F35-P48 HydrophobicContact CZ-CG 4.25Å; P48-P115 VanDerWaalsContact CB-C 3.49Å; P48-P115 HydrophobicContact CB-CB 3.91Å; P48-P115 WeakPolarHBondContact CB-O 3.12Å; P48-I117 HydrophobicContact CB-CG1 4.5Å; P48-I117 HydrophobicContact CG-CD1 3.81Å; P48-I117 HydrophobicContact CG-CG1 3.73Å; P48-W138 HydrophobicContact CG-CD2 3.9Å; P48-W138 HydrophobicContact CG-CE3 3.64Å; P48-W138 HydrophobicContact CG-CH2 3.63Å; P48-W138 HydrophobicContact CG-CZ2 3.83Å; P48-W138 HydrophobicContact CG-CZ3 3.51Å
49	V	83	Confident	69.9	Low	98 Å²	98	86.9 Å²	86.9	59%	0.594	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	134	172.9	178.3	0	0	0	0	109.2	K116 I117	V49-K116 WeakPolarHBondContact O-CA 3.48Å; V49-I117 PolarHBondContact O-N 3.13Å
50	V	85.5	Confident	67.2	Low	11 Å²	11	92.7 Å²	92.7	7%	0.067	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.2	167.7	-173.4	0	0	0	0	107.8	L31 E32 F35 I117 I119	L31-V50 HydrophobicContact CD2-CG1 4.48Å; E32-V50 HydrophobicContact CB-CB 4.09Å; E32-V50 HydrophobicContact CB-CG1 4.13Å; E32-V50 HydrophobicContact CG-CB 4.13Å; F35-V50 HydrophobicContact CB-CG2 4.2Å; F35-V50 HydrophobicContact CD1-CG2 3.8Å; F35-V50 HydrophobicContact CG-CG2 4.28Å; V50-I117 CarbonylContact C-O 3.45Å; V50-I117 WeakPolarHBondContact CA-O 3.13Å; V50-I117 HydrophobicContact CG1-CG2 4.35Å; V50-I117 HydrophobicContact CG2-CB 4.17Å; V50-I117 HydrophobicContact CG2-CD1 4.26Å; V50-I117 HydrophobicContact CG2-CG2 4.49Å; V50-I119 HydrophobicContact CG1-CD1 4.02Å; V50-I119 HydrophobicContact CG1-CG1 4.42Å; V50-I119 HydrophobicContact CG1-CG2 3.66Å
51	S	83.7	Confident	64.5	Low	38 Å²	38	92.2 Å²	92.2	27%	0.266	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.1	-174.7	56.1	0	0	0	0	111.2	I117 I118 I119	S51-I117 PolarHBondContact N-O 3.43Å; S51-I117 PolarHBondContact OG-O 3.2Å; S51-I118 CarbonylContact O-C 3.22Å; S51-I118 VanDerWaalsContact O-CA 3.32Å; S51-I118 WeakPolarHBondContact O-CA 3.32Å; S51-I119 PolarHBondContact O-N 2.84Å
52	T	82.3	Confident	62.1	Low	59 Å²	59	94.4 Å²	94.4	36%	0.362	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	130.9	177.4	50	0	0	0	0	111.1	H54 I119	T52-H54 PolarHBondContact O-N 2.98Å; T52-I119 WeakPolarHBondContact CA-O 3.41Å; T52-I119 HydrophobicContact CG2-CD1 3.75Å; T52-I119 HydrophobicContact CG2-CG1 3.71Å
53	K	77.5	Confident	59.7	Low	130 Å²	130	99.1 Å²	99.1	57%	0.565	56%	0.563	S	S	*	*			trans	-80.7	112.2	169.9	-167.5	-178.4	-179.9	-170.3	0	109.1	S55 I118 I119	K53-S55 PolarHBondContact O-N 3.49Å; K53-I118 HydrophobicContact CB-CG2 3.84Å; K53-I119 PolarHBondContact N-O 3.3Å
54	H	58.1	Low	57.4	Low	149 Å²	149	100.9 Å²	100.9	69%	0.69	57%	0.567	S	S	*	*			trans	-69.7	114	168.8	-63.6	-63.7	0	0	0	109.1	T52 Q56	T52-H54 PolarHBondContact O-N 2.98Å; H54-Q56 PolarHBondContact O-N 3.27Å; H54-Q56 VanDerWaalsContact O-N 3.15Å
55	S	44.9	Very low	55.2	Low	96 Å²	96	105.4 Å²	105.4	67%	0.671	60%	0.6	S	S	*	*			trans	-69.1	106.8	169.6	-167.4	0	0	0	0	108	K53 A57	K53-S55 PolarHBondContact O-N 3.49Å; S55-A57 VanDerWaalsContact C-N 3.35Å; S55-A57 PolarHBondContact O-N 3.38Å
56	Q	34.6	Very low	53.2	Low	182 Å²	182	107.9 Å²	107.9	85%	0.85	61%	0.607	S	S	*	*			trans	-69.8	98.4	163.6	-74.3	179.4	-8.2	0	0	106.9	H54 I58	H54-Q56 PolarHBondContact O-N 3.27Å; H54-Q56 VanDerWaalsContact O-N 3.15Å; Q56-I58 PolarHBondContact O-N 2.97Å
57	A	32.2	Very low	51.4	Low	76 Å²	76	106.7 Å²	106.7	63%	0.628	61%	0.612	S	S	*	*			trans	-60.8	121.3	162.3	0	0	0	0	0	107.3	S55 I59	S55-A57 VanDerWaalsContact C-N 3.35Å; S55-A57 PolarHBondContact O-N 3.38Å; A57-I59 VanDerWaalsContact C-N 3.27Å; A57-I59 PolarHBondContact O-N 3.11Å
58	I	30.6	Very low	49.2	Very low	157 Å²	157	110 Å²	110	81%	0.805	64%	0.636	S	S	*	*			trans	-65.9	93.9	168.7	-61	171.5	0	0	0	105.9	Q56 T60	Q56-I58 PolarHBondContact O-N 2.97Å; I58-T60 PolarHBondContact O-N 3.19Å
59	I	29.8	Very low	47.2	Very low	126 Å²	126	114.2 Å²	114.2	65%	0.646	67%	0.666	S	S	*	*			trans	-81	100.4	165.8	-55	178.1	0	0	0	105.8	A57 Q61	A57-I59 VanDerWaalsContact C-N 3.27Å; A57-I59 PolarHBondContact O-N 3.11Å; I59-Q61 HydrophobicContact CG2-CG 3.56Å; I59-Q61 PolarHBondContact O-N 3.38Å
60	T	30.7	Very low	45.1	Very low	125 Å²	125	118.8 Å²	118.8	77%	0.767	68%	0.678	S	S	*	*			trans	-67.9	83.4	164.5	-13.9	0	0	0	0	107.6	I58 T62	I58-T60 PolarHBondContact O-N 3.19Å; T60-T62 PolarHBondContact O-N 2.87Å
61	Q	32.6	Very low	42.7	Very low	162 Å²	162	130.1 Å²	130.1	76%	0.757	72%	0.719	S	S	*	*			trans	-74.5	107.2	168.1	-72.2	-167.4	-12.3	0	0	108.3	I59 V63	I59-Q61 HydrophobicContact CG2-CG 3.56Å; I59-Q61 PolarHBondContact O-N 3.38Å; Q61-V63 PolarHBondContact O-N 3.41Å; Q61-V63 VanDerWaalsContact O-N 3.11Å
62	T	33.7	Very low	40.6	Very low	124 Å²	124	133.3 Å²	133.3	76%	0.761	74%	0.742	S	S	*	*			trans	-58.5	106.5	161.6	33.9	0	0	0	0	108.8	T60 S64	T60-T62 PolarHBondContact O-N 2.87Å; T62-S64 PolarHBondContact O-N 3.04Å
63	V	33.7	Very low	38.8	Very low	147 Å²	147	139.2 Å²	139.2	89%	0.891	76%	0.762	S	S	*	*			trans	-67.5	104.7	174.4	-137.7	0	0	0	0	107.7	Q61	Q61-V63 PolarHBondContact O-N 3.41Å; Q61-V63 VanDerWaalsContact O-N 3.11Å
64	S	36.3	Very low	37.1	Very low	95 Å²	95	138.9 Å²	138.9	66%	0.664	77%	0.767	S	S	*	*			trans	-133.8	129.8	167.8	54.7	0	0	0	0	109.2	T62	T62-S64 PolarHBondContact O-N 3.04Å
65	S	37.5	Very low	36.4	Very low	116 Å²	116	137.1 Å²	137.1	81%	0.811	76%	0.762	S	S	*	*			trans	73.3	96.3	172.4	68.5	0	0	0	0	118.4
66	L	35.1	Very low	36.3	Very low	170 Å²	170	140.7 Å²	140.7	89%	0.89	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-82.2	134.1	149.1	-80.6	102.9	0	0	0	109.4
67	P	36.3	Very low	36.6	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-97.1	137.1	160.7	1.5	18.8	0	0	0	111.9
68	S	32.9	Very low	36.9	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-48.1	145.4	172.4	53.6	0	0	0	0	116.6
69	S	41.2	Very low	37.5	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	77%	0.771	S	S	*	*				-179.6	137.9	113.1	56.7	0	0	0	0	115.3
70	K	38.5	Very low	37.9	Very low	195 Å²	195	144.2 Å²	144.2	85%	0.848	78%	0.782	S	S	*	*			trans	68.6	99.3	151.8	-67.7	171.5	179.7	177	0	118.5
71	R	35.1	Very low	38.2	Very low	249 Å²	249	142.4 Å²	142.4	94%	0.94	78%	0.775	S	S	*	*				53.7	119.3	94.1	-74.4	-173.4	-178.9	-175.6	1.1	112.1
72	S	39.6	Very low	38.4	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	78%	0.775	S	S	*	*				-166.7	141.3	58.3	50	0	0	0	0	114.7
73	K	43.2	Very low	38.4	Very low	182 Å²	182	143.3 Å²	143.3	79%	0.791	78%	0.775	S	S	*	*			trans	48.5	130.8	130.8	-75.1	-167.1	172.2	-177.3	0	119.4
74	D	43.3	Very low	38.3	Very low	123 Å²	123	141 Å²	141	66%	0.658	77%	0.765	S	S	*	*			cis	-160.1	157.6	26.4	-92.4	-36.2	0	0	0	112.5
75	D	42	Very low	38.4	Very low	112 Å²	112	142 Å²	142	60%	0.599	77%	0.772	S	S	*	*			trans	52.8	108.2	146.1	-68.9	-39.9	0	0	0	122.5
76	K	42.7	Very low	38.1	Very low	172 Å²	172	142.7 Å²	142.7	75%	0.748	77%	0.771	S	S	*	*				84.3	101.7	84.9	-85.6	-171.7	-164.4	108.8	0	114.8
77	K	42.1	Very low	38.1	Very low	204 Å²	204	141.2 Å²	141.2	89%	0.887	77%	0.77	S	S	*	*				164.8	137.8	96.1	-105.8	176.5	176.7	179	0	110.2
78	S	37.4	Very low	37.9	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	77%	0.772	S	S	*	*			trans	-101.7	-166.7	-174.6	56.8	0	0	0	0	110.7
79	P	43.7	Very low	38	Very low	112 Å²	112	150.6 Å²	150.6	73%	0.727	78%	0.779	S	S	*	*				-127.1	-168.6	-106.2	33.7	-10.6	0	0	0	112
80	Q	37.6	Very low	37.7	Very low	187 Å²	187	150.5 Å²	150.5	87%	0.874	78%	0.778	S	S	*	*			trans	133.5	147.4	164.4	-82	171.8	-11.6	0	0	109.3
81	S	38.2	Very low	37.4	Very low	87 Å²	87	148.6 Å²	148.6	61%	0.608	78%	0.778	S	S	*	*			cis	-178.9	146.7	-10.4	49.9	0	0	0	0	106.3
82	Q	36.5	Very low	37.5	Very low	163 Å²	163	146 Å²	146	76%	0.762	78%	0.776	S	S	*	*			trans	70	128.5	143.6	-71.3	180	3.8	0	0	122.2
83	N	32.9	Very low	37.3	Very low	141 Å²	141	148.6 Å²	148.6	75%	0.754	78%	0.78	S	S	*	*			trans	66.4	146.6	134.5	-65.1	-4.7	0	0	0	117.8
84	S	32.8	Very low	37	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	78%	0.781	S	S	*	*			cis	172.3	137.8	-6	46.6	0	0	0	0	104
85	S	37.5	Very low	36.8	Very low	115 Å²	115	148 Å²	148	80%	0.804	79%	0.786	S	S	*	*			trans	157.9	113.5	140.7	59.6	0	0	0	0	114.3
86	V	31.6	Very low	36.8	Very low	130 Å²	130	148 Å²	148	79%	0.788	79%	0.792	S	S	*	*			trans	8.7	127.6	134.8	-171.4	0	0	0	0	118.8
87	T	34.7	Very low	36.6	Very low	140 Å²	140	147.8 Å²	147.8	86%	0.859	80%	0.798	S	S	*	*				-166.2	145.8	122.8	18.1	0	0	0	0	112.3
88	K	32	Very low	36.4	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.826	80%	0.799	S	S	*	*			trans	-63.8	150.6	-178	-62.3	168.3	173.3	177.3	0	112.8
89	Y	34.9	Very low	36.5	Very low	239 Å²	239	146.2 Å²	146.2	94%	0.937	80%	0.803	S	S	*	*			trans	-160.8	147.7	140.8	-97.5	-73	0	0	0	112.2
90	S	35.4	Very low	36.8	Very low	103 Å²	103	148.1 Å²	148.1	72%	0.72	81%	0.807	S	S	*	*			trans	-80.6	158.7	-173.3	-42.7	0	0	0	0	114.4
91	D	32.3	Very low	37.1	Very low	155 Å²	155	143.9 Å²	143.9	83%	0.829	80%	0.796	S	S	*	*			trans	18.4	109.4	149.7	-57.7	-29.2	0	0	0	119.4
92	E	37	Very low	37.8	Very low	195 Å²	195	146.6 Å²	146.6	91%	0.911	81%	0.808	S	S	*	*				172.6	149.9	105	-101.8	-177.2	157.1	0	0	111.6
93	I	35.4	Very low	38.4	Very low	158 Å²	158	144.2 Å²	144.2	81%	0.81	81%	0.805	S	S	*	*			trans	-57.8	125.9	-168.4	-62.6	158.2	0	0	0	113.6
94	Q	37.6	Very low	39.1	Very low	176 Å²	176	146.1 Å²	146.1	82%	0.822	81%	0.807	S	S	*	*				-169.5	130.6	126.1	-76.2	-145.7	-12	0	0	110.2
95	P	38.9	Very low	39.9	Very low	117 Å²	117	151 Å²	151	76%	0.76	82%	0.816	S	S	*	*			trans	-87.5	138.1	168.2	34.3	-27.1	0	0	0	109.2
96	P	40.9	Very low	40.3	Very low	111 Å²	111	153.3 Å²	153.3	72%	0.721	82%	0.819	S	S	*	*				-156.3	99.7	114.2	33.9	-12.8	0	0	0	113.3
97	L	38.5	Very low	40.9	Very low	168 Å²	168	151.8 Å²	151.8	88%	0.88	81%	0.813	S	S	*	*			trans	-142.2	114.3	157.7	-77.6	176.2	0	0	0	110	F99	L97-F99 PolarHBondContact O-N 2.82Å
98	G	39	Very low	41.6	Very low	88 Å²	88	154.2 Å²	154.2	91%	0.907	81%	0.811	S	S	*	*			trans	-71	79.6	-172.6	0	0	0	0	0	114.3
99	F	40	Very low	42.6	Very low	196 Å²	196	149 Å²	149	86%	0.86	80%	0.795	S	S	*	*			trans	-103.7	97	160.4	-92.8	-91.5	0	0	0	109.5	L97 P101	L97-F99 PolarHBondContact O-N 2.82Å; F99-P101 VanDerWaalsContact O-CD 3.32Å; F99-P101 WeakPolarHBondContact O-CD 3.42Å
100	N	48.4	Very low	43.5	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	78%	0.781	S	S	*	*			trans	-90.3	106.9	162.1	-88.7	-29.7	0	0	0	107.9	T102	N100-T102 PolarHBondContact O-N 2.83Å; N100-T102 VanDerWaalsContact O-N 3.1Å
101	P	44.4	Very low	44.4	Very low	99 Å²	99	143.5 Å²	143.5	64%	0.643	77%	0.77	S	S	*	*			trans	-65.3	113.2	174.2	25.4	-30.3	0	0	0	109.2	F99 T103	F99-P101 VanDerWaalsContact O-CD 3.32Å; F99-P101 WeakPolarHBondContact O-CD 3.42Å; P101-T103 PolarHBondContact O-N 2.78Å
102	T	54.3	Low	45.3	Very low	143 Å²	143	143.6 Å²	143.6	88%	0.877	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-0.6	-179.4	43.3	0	0	0	0	113.7	N100	N100-T102 PolarHBondContact O-N 2.83Å; N100-T102 VanDerWaalsContact O-N 3.1Å
103	T	47.6	Very low	46.4	Very low	114 Å²	114	139.5 Å²	139.5	70%	0.699	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-8.6	-169.9	-8.1	0	0	0	0	115	P101	P101-T103 PolarHBondContact O-N 2.78Å
104	F	48.2	Very low	48.1	Very low	180 Å²	180	137.5 Å²	137.5	79%	0.789	73%	0.729	S	S	*	*			trans	-142	113.7	171.9	-67.7	-82.2	0	0	0	110.7	L106	F104-L106 PolarHBondContact O-N 3.04Å
105	K	49.4	Very low	49.9	Very low	202 Å²	202	131.6 Å²	131.6	88%	0.878	71%	0.706	S	S	*	*			trans	-70.7	118.4	161.9	-81.9	-178	177.4	177	0	107.6	C107	K105-C107 PolarHBondContact O-N 3.2Å
106	L	45.2	Very low	52	Low	165 Å²	165	129.9 Å²	129.9	86%	0.864	69%	0.687	S	S	*	*			trans	-63.8	85.6	165.2	-148.8	85.5	0	0	0	107.6	F104 K108	F104-L106 PolarHBondContact O-N 3.04Å; L106-K108 PolarHBondContact O-N 2.77Å
107	C	45.7	Very low	54.4	Low	98 Å²	98	124.7 Å²	124.7	66%	0.662	65%	0.653	S	S	*	*			trans	-58.5	134.1	167.1	-88.4	0	0	0	0	106.9	K105 T109	K105-C107 PolarHBondContact O-N 3.2Å; C107-T109 PolarHBondContact O-N 3.3Å; C107-T109 PolarHBondContact O-OG1 3.43Å
108	K	48.3	Very low	56.8	Low	190 Å²	190	119.2 Å²	119.2	83%	0.826	62%	0.624	S	S	*	*			trans	-45.1	109.2	176	-69.4	-179.2	178.6	-179.9	0	108.6	L106 L110 E111	L106-K108 PolarHBondContact O-N 2.77Å; K108-L110 PolarHBondContact O-N 3.34Å; K108-E111 PolarHBondContact O-N 2.77Å
109	T	54.2	Low	59.4	Low	81 Å²	81	115.1 Å²	115.1	50%	0.497	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69	33.8	-164.7	-36	0	0	0	0	113.2	C107 Y112	C107-T109 PolarHBondContact O-N 3.3Å; C107-T109 PolarHBondContact O-OG1 3.43Å; T109-Y112 HydrophobicContact CG2-CE1 3.63Å; T109-Y112 WeakPolarHBondContact O-CE1 3.24Å; T109-Y112 PolarHBondContact O-OH 3.24Å
110	L	53.2	Low	61.8	Low	122 Å²	122	108.4 Å²	108.4	64%	0.639	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	-14.7	179.6	-63.6	173.6	0	0	0	112.3	K108 Y112 L113 K114	K108-L110 PolarHBondContact O-N 3.34Å; L110-Y112 VanDerWaalsContact C-N 3.28Å; L110-Y112 PolarHBondContact O-N 3.15Å; L110-L113 HydrophobicContact CD2-CD1 3.91Å; L110-L113 WeakPolarHBondContact O-CB 3.43Å; L110-L113 PolarHBondContact O-N 3.3Å; L110-K114 PolarHBondContact O-N 3.1Å
111	E	53	Low	63.7	Low	105 Å²	105	102.6 Å²	102.6	49%	0.491	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-69.9	-26.4	-178.2	-167.7	140.5	-113.2	0	0	113.3	K108 L113 K114	K108-E111 PolarHBondContact O-N 2.77Å; E111-L113 VanDerWaalsContact C-N 3.26Å; E111-K114 HydrophobicContact CG-CD 4.32Å; E111-K114 PolarHBondContact O-N 3.12Å; E111-K114 IonicContact OE1-NZ 3.12Å; E111-K114 PolarHBondContact OE1-NZ 2.88Å
112	Y	51.7	Low	65.7	Low	156 Å²	156	103.8 Å²	103.8	61%	0.612	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-72.8	-19.4	171.7	71.3	-94	0	0	0	113	T109 L110	T109-Y112 HydrophobicContact CG2-CE1 3.63Å; T109-Y112 WeakPolarHBondContact O-CE1 3.24Å; T109-Y112 PolarHBondContact O-OH 3.24Å; L110-Y112 VanDerWaalsContact C-N 3.28Å; L110-Y112 PolarHBondContact O-N 3.15Å
113	L	61.1	Low	67.1	Low	110 Å²	110	99.6 Å²	99.6	58%	0.576	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-88.4	-9.9	177.2	-65.3	175.7	0	0	0	112.7	L110 E111 P115	L110-L113 HydrophobicContact CD2-CD1 3.91Å; L110-L113 WeakPolarHBondContact O-CB 3.43Å; L110-L113 PolarHBondContact O-N 3.3Å; E111-L113 VanDerWaalsContact C-N 3.26Å; L113-P115 WeakPolarHBondContact O-CD 3.32Å
114	K	70.4	Confident	68.7	Low	115 Å²	115	98.6 Å²	98.6	50%	0.5	49%	0.485	S	S	.	.	S	Bend	trans	-65.7	130.6	178.6	-69.8	-179.3	-175.6	169	0	109.3	L110 E111 K116	L110-K114 PolarHBondContact O-N 3.1Å; E111-K114 HydrophobicContact CG-CD 4.32Å; E111-K114 PolarHBondContact O-N 3.12Å; E111-K114 IonicContact OE1-NZ 3.12Å; E111-K114 PolarHBondContact OE1-NZ 2.88Å; K114-K116 PolarHBondContact O-N 2.88Å
115	P	76	Confident	70.4	Confident	52 Å²	52	96.9 Å²	96.9	34%	0.338	48%	0.484	S	S	.	.			trans	-47.3	128.8	168.9	-34.1	40.3	0	0	0	111.9	P48 L113 W138	P48-P115 VanDerWaalsContact CB-C 3.49Å; P48-P115 HydrophobicContact CB-CB 3.91Å; P48-P115 WeakPolarHBondContact CB-O 3.12Å; L113-P115 WeakPolarHBondContact O-CD 3.32Å; P115-W138 HydrophobicContact CB-CB 3.86Å; P115-W138 HydrophobicContact CB-CD2 4.38Å; P115-W138 HydrophobicContact CB-CG 3.65Å; P115-W138 HydrophobicContact CG-CB 4.33Å; P115-W138 HydrophobicContact CG-CG 4.17Å
116	K	82.7	Confident	72.1	Confident	82 Å²	82	92.1 Å²	92.1	36%	0.357	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.6	177.4	-71	178.4	-172.8	-178.1	0	109.9	V49 K114	V49-K116 WeakPolarHBondContact O-CA 3.48Å; K114-K116 PolarHBondContact O-N 2.88Å
117	I	90.5	Very high	73.9	Confident	1 Å²	1	86.3 Å²	86.3	1%	0.005	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122	163.9	-61.3	171.8	0	0	0	105.9	F35 P48 V49 V50 S51 I119 V133 I135 W138 L148	F35-I117 HydrophobicContact CD1-CD1 3.79Å; F35-I117 HydrophobicContact CD2-CD1 4.11Å; F35-I117 HydrophobicContact CE1-CD1 3.46Å; F35-I117 VanDerWaalsContact CE1-CD1 3.46Å; F35-I117 HydrophobicContact CE2-CD1 3.85Å; F35-I117 HydrophobicContact CG-CD1 4.1Å; F35-I117 HydrophobicContact CZ-CD1 3.51Å; P48-I117 HydrophobicContact CB-CG1 4.5Å; P48-I117 HydrophobicContact CG-CD1 3.81Å; P48-I117 HydrophobicContact CG-CG1 3.73Å; V49-I117 PolarHBondContact O-N 3.13Å; V50-I117 CarbonylContact C-O 3.45Å; V50-I117 WeakPolarHBondContact CA-O 3.13Å; V50-I117 HydrophobicContact CG1-CG2 4.35Å; V50-I117 HydrophobicContact CG2-CB 4.17Å; V50-I117 HydrophobicContact CG2-CD1 4.26Å; V50-I117 HydrophobicContact CG2-CG2 4.49Å; S51-I117 PolarHBondContact N-O 3.43Å; S51-I117 PolarHBondContact OG-O 3.2Å; I117-I119 HydrophobicContact CG2-CG2 4.25Å; I117-V133 HydrophobicContact CG2-CG1 3.73Å; I117-I135 HydrophobicContact CD1-CD1 4.31Å; I117-I135 HydrophobicContact CG1-CD1 4.08Å; I117-I135 HydrophobicContact CG1-CG1 4.08Å; I117-I135 HydrophobicContact CG2-CG1 4.28Å; I117-W138 HydrophobicContact CD1-CZ3 4.24Å; I117-W138 HydrophobicContact CG1-CZ3 4.48Å; I117-L148 HydrophobicContact CD1-CD2 3.97Å
118	I	90.3	Very high	75.8	Confident	54 Å²	54	86.1 Å²	86.1	28%	0.277	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.7	180	-59.9	170.2	0	0	0	107.5	S51 K53 S134	S51-I118 CarbonylContact O-C 3.22Å; S51-I118 VanDerWaalsContact O-CA 3.32Å; S51-I118 WeakPolarHBondContact O-CA 3.32Å; K53-I118 HydrophobicContact CB-CG2 3.84Å; I118-S134 PolarHBondContact N-O 2.77Å; I118-S134 WeakPolarHBondContact O-CB 3.45Å; I118-S134 PolarHBondContact O-N 3.35Å
119	I	92.2	Very high	77.7	Confident	2 Å²	2	77.8 Å²	77.8	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	143.7	177.3	69	-178.6	0	0	0	110.1	L31 V50 S51 T52 K53 I117 V130 E132 V133	L31-I119 HydrophobicContact CD2-CG2 3.39Å; V50-I119 HydrophobicContact CG1-CD1 4.02Å; V50-I119 HydrophobicContact CG1-CG1 4.42Å; V50-I119 HydrophobicContact CG1-CG2 3.66Å; S51-I119 PolarHBondContact O-N 2.84Å; T52-I119 WeakPolarHBondContact CA-O 3.41Å; T52-I119 HydrophobicContact CG2-CD1 3.75Å; T52-I119 HydrophobicContact CG2-CG1 3.71Å; K53-I119 PolarHBondContact N-O 3.3Å; I117-I119 HydrophobicContact CG2-CG2 4.25Å; I119-V130 HydrophobicContact CB-CG1 4.2Å; I119-V130 HydrophobicContact CB-CG2 4.41Å; I119-V130 HydrophobicContact CD1-CG2 3.99Å; I119-E132 CarbonylContact C-O 3.56Å; I119-E132 WeakPolarHBondContact CA-O 3.3Å; I119-V133 HydrophobicContact CG2-CG2 4.27Å
120	Q	90.6	Very high	79.5	Confident	54 Å²	54	74.1 Å²	74.1	25%	0.252	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.5	166.3	-168.2	174.3	-31.9	0	0	108.5	V130 N131 E132	Q120-V130 CarbonylContact O-C 3.13Å; Q120-V130 WeakPolarHBondContact O-CA 3.48Å; Q120-N131 PolarHBondContact O-N 3.46Å; Q120-N131 PolarHBondContact O-OD1 2.71Å; Q120-N131 VanDerWaalsContact O-OD1 3.04Å; Q120-E132 HydrophobicContact CB-CB 3.95Å; Q120-E132 PolarHBondContact N-O 3.3Å; Q120-E132 PolarHBondContact O-N 2.91Å
121	Q	87.9	Confident	81.5	Confident	30 Å²	30	69.7 Å²	69.7	14%	0.14	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	147.2	-179.5	-72.2	161.3	-34.7	0	0	109.2	N123 T129 V130	Q121-N123 VanDerWaalsContact C-N 3.3Å; Q121-T129 WeakPolarHBondContact CA-O 3.45Å; Q121-V130 HydrophobicContact CG-CB 4.3Å; Q121-V130 HydrophobicContact CG-CG2 3.52Å
122	E	86.5	Confident	83.5	Confident	123 Å²	123	66 Å²	66	58%	0.575	33%	0.328	S	S	*	.	S	Bend	trans	-67.8	-36.5	170.1	-61.2	179	167.9	0	0	110.7	T129 N131	E122-T129 PolarHBondContact N-O 3.36Å; E122-N131 HydrophobicContact CG-CB 4.18Å; E122-N131 WeakPolarHBondContact CG-ND2 3.42Å
123	N	84.1	Confident	85.6	Confident	56 Å²	56	58.7 Å²	58.7	30%	0.299	30%	0.299	S	S	.	.	S	Bend	trans	-132.9	116.2	175.8	-176.5	-12.4	0	0	0	110.1	Q121 D125 K126 T129	Q121-N123 VanDerWaalsContact C-N 3.3Å; N123-D125 PolarHBondContact O-N 3.28Å; N123-D125 VanDerWaalsContact O-N 3.15Å; N123-D125 PolarHBondContact OD1-N 3.46Å; N123-K126 HydrophobicContact CB-CB 4.17Å; N123-K126 HydrophobicContact CB-CG 4.45Å; N123-K126 PolarHBondContact O-N 3.1Å; N123-T129 HydrophobicContact CB-CG2 4.47Å; N123-T129 PolarHBondContact N-OG1 3.43Å; N123-T129 PolarHBondContact O-OG1 3.25Å
124	P	81.8	Confident	87.3	Confident	92 Å²	92	53.9 Å²	53.9	60%	0.597	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.8	178.4	-25.7	34.8	0	0	0	114.8	K126	P124-K126 VanDerWaalsContact C-N 3.28Å; P124-K126 PolarHBondContact O-N 3.06Å
125	D	83.3	Confident	88.4	Confident	144 Å²	144	48.4 Å²	48.4	77%	0.77	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.5	-179	-58.6	-39.6	0	0	0	112.9	N123	N123-D125 PolarHBondContact O-N 3.28Å; N123-D125 VanDerWaalsContact O-N 3.15Å; N123-D125 PolarHBondContact OD1-N 3.46Å
126	K	84.7	Confident	89.1	Confident	103 Å²	103	50.9 Å²	50.9	45%	0.448	26%	0.256	S	S	.	.			trans	-123.7	93.1	-175.2	-68.8	-170	178.4	-170.9	0	110.7	N123 P124 E128 T129	N123-K126 HydrophobicContact CB-CB 4.17Å; N123-K126 HydrophobicContact CB-CG 4.45Å; N123-K126 PolarHBondContact O-N 3.1Å; P124-K126 VanDerWaalsContact C-N 3.28Å; P124-K126 PolarHBondContact O-N 3.06Å; K126-E128 VanDerWaalsContact C-OE2 3.25Å; K126-E128 WeakPolarHBondContact CA-OE2 3.19Å; K126-E128 WeakPolarHBondContact CB-OE1 3.23Å; K126-E128 PolarHBondContact O-N 3.03Å; K126-E128 VanDerWaalsContact O-N 3.09Å; K126-T129 HydrophobicContact CB-CG2 3.62Å; K126-T129 HydrophobicContact CD-CG2 4.3Å; K126-T129 WeakPolarHBondContact O-CB 3.44Å; K126-T129 PolarHBondContact O-N 3.33Å; K126-T129 PolarHBondContact O-OG1 2.9Å
127	P	83.1	Confident	89.3	Confident	43 Å²	43	49 Å²	49	28%	0.279	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-60.4	-22.9	-174.5	24.3	-33.8	0	0	0	114	N30 T129 V130	N30-P127 HydrophobicContact CB-CB 4.07Å; N30-P127 HydrophobicContact CB-CG 4.44Å; P127-T129 PolarHBondContact O-N 2.85Å; P127-V130 WeakPolarHBondContact O-CG2 3.36Å
128	E	85.3	Confident	89.2	Confident	93 Å²	93	50 Å²	50	44%	0.435	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-70	-12.7	175.3	69.5	-83.1	-167.6	0	0	113.9	K126 V130	K126-E128 VanDerWaalsContact C-OE2 3.25Å; K126-E128 WeakPolarHBondContact CA-OE2 3.19Å; K126-E128 WeakPolarHBondContact CB-OE1 3.23Å; K126-E128 PolarHBondContact O-N 3.03Å; K126-E128 VanDerWaalsContact O-N 3.09Å; E128-V130 VanDerWaalsContact C-N 3.29Å; E128-V130 PolarHBondContact O-N 3.41Å
129	T	89.8	Confident	89.2	Confident	15 Å²	15	54.6 Å²	54.6	9%	0.092	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-90.4	19.2	-176.8	68.6	0	0	0	0	114.1	Q121 E122 N123 K126 P127 N131	Q121-T129 WeakPolarHBondContact CA-O 3.45Å; E122-T129 PolarHBondContact N-O 3.36Å; N123-T129 HydrophobicContact CB-CG2 4.47Å; N123-T129 PolarHBondContact N-OG1 3.43Å; N123-T129 PolarHBondContact O-OG1 3.25Å; K126-T129 HydrophobicContact CB-CG2 3.62Å; K126-T129 HydrophobicContact CD-CG2 4.3Å; K126-T129 WeakPolarHBondContact O-CB 3.44Å; K126-T129 PolarHBondContact O-N 3.33Å; K126-T129 PolarHBondContact O-OG1 2.9Å; P127-T129 PolarHBondContact O-N 2.85Å; T129-N131 PolarHBondContact O-N 3.38Å
130	V	92	Very high	89.1	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.024	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	119.5	175.3	175	0	0	0	0	109.5	I119 Q120 Q121 P127 E128 V133 K157 L158	I119-V130 HydrophobicContact CB-CG1 4.2Å; I119-V130 HydrophobicContact CB-CG2 4.41Å; I119-V130 HydrophobicContact CD1-CG2 3.99Å; Q120-V130 CarbonylContact O-C 3.13Å; Q120-V130 WeakPolarHBondContact O-CA 3.48Å; Q121-V130 HydrophobicContact CG-CB 4.3Å; Q121-V130 HydrophobicContact CG-CG2 3.52Å; P127-V130 WeakPolarHBondContact O-CG2 3.36Å; E128-V130 VanDerWaalsContact C-N 3.29Å; E128-V130 PolarHBondContact O-N 3.41Å; V130-V133 HydrophobicContact CG1-CG2 3.94Å; V130-K157 CarbonylContact O-C 3.57Å; V130-K157 VanDerWaalsContact O-C 3.22Å; V130-L158 HydrophobicContact CG1-CD1 4.27Å; V130-L158 WeakPolarHBondContact O-CA 3.47Å; V130-L158 PolarHBondContact O-N 3.49Å; V130-L158 VanDerWaalsContact O-N 3.09Å
131	N	93.7	Very high	89.2	Confident	30 Å²	30	54.6 Å²	54.6	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-19.7	-178.4	66.5	6.5	0	0	0	113.6	Q120 E122 T129 K157 S159 K160	Q120-N131 PolarHBondContact O-N 3.46Å; Q120-N131 PolarHBondContact O-OD1 2.71Å; Q120-N131 VanDerWaalsContact O-OD1 3.04Å; E122-N131 HydrophobicContact CG-CB 4.18Å; E122-N131 WeakPolarHBondContact CG-ND2 3.42Å; T129-N131 PolarHBondContact O-N 3.38Å; N131-K157 WeakPolarHBondContact CA-O 3.39Å; N131-S159 PolarHBondContact O-N 2.93Å; N131-S159 PolarHBondContact O-OG 3.39Å; N131-K160 PolarHBondContact O-N 3.06Å
132	E	96.2	Very high	89.4	Confident	28 Å²	28	55.9 Å²	55.9	13%	0.131	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	135.5	175.7	175.7	174.5	171.7	0	0	111.3	I119 Q120 S134 K160 V162	I119-E132 CarbonylContact C-O 3.56Å; I119-E132 WeakPolarHBondContact CA-O 3.3Å; Q120-E132 HydrophobicContact CB-CB 3.95Å; Q120-E132 PolarHBondContact N-O 3.3Å; Q120-E132 PolarHBondContact O-N 2.91Å; E132-S134 PolarHBondContact OE1-OG 3.01Å; E132-K160 VanDerWaalsContact CA-O 3.28Å; E132-K160 WeakPolarHBondContact CA-O 3.23Å; E132-K160 HydrophobicContact CB-CB 4.04Å; E132-K160 HydrophobicContact CB-CD 4.49Å; E132-K160 HydrophobicContact CB-CG 4.41Å; E132-K160 VanDerWaalsContact CD-CE 3.46Å; E132-K160 HydrophobicContact CG-CB 4.1Å; E132-K160 HydrophobicContact CG-CD 4.04Å; E132-K160 HydrophobicContact CG-CG 3.94Å; E132-K160 WeakPolarHBondContact OE1-CE 3.44Å; E132-K160 IonicContact OE1-NZ 2.72Å; E132-K160 PolarHBondContact OE1-NZ 3.3Å; E132-K160 VanDerWaalsContact OE2-CD 3.31Å; E132-K160 WeakPolarHBondContact OE2-CD 3.38Å; E132-K160 WeakPolarHBondContact OE2-CE 3.36Å; E132-K160 IonicContact OE2-NZ 3.01Å; E132-K160 PolarHBondContact OE2-NZ 3.14Å; E132-V162 HydrophobicContact CG-CG2 4.47Å
133	V	96.2	Very high	89.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.6	168.3	177.9	0	0	0	0	109.2	L31 I117 I119 V130 I135 F152 L158 K160 L161 V162	L31-V133 HydrophobicContact CD2-CG1 4.36Å; L31-V133 HydrophobicContact CD2-CG2 3.61Å; I117-V133 HydrophobicContact CG2-CG1 3.73Å; I119-V133 HydrophobicContact CG2-CG2 4.27Å; V130-V133 HydrophobicContact CG1-CG2 3.94Å; V133-I135 HydrophobicContact CG1-CG1 4.21Å; V133-F152 HydrophobicContact CB-CE1 4.14Å; V133-F152 HydrophobicContact CG1-CE1 3.91Å; V133-F152 HydrophobicContact CG1-CZ 4.2Å; V133-F152 HydrophobicContact CG2-CE1 4.05Å; V133-L158 HydrophobicContact CB-CD1 4.29Å; V133-L158 HydrophobicContact CG2-CD1 3.71Å; V133-L158 HydrophobicContact CG2-CD2 4.11Å; V133-K160 PolarHBondContact N-O 2.96Å; V133-L161 HydrophobicContact CB-CD2 4.02Å; V133-V162 PolarHBondContact O-N 2.87Å
134	S	95.6	Very high	90.1	Very high	9 Å²	9	50.9 Å²	50.9	6%	0.063	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.6	-178.8	-83.8	0	0	0	0	110.7	I118 E132 V162	I118-S134 PolarHBondContact N-O 2.77Å; I118-S134 WeakPolarHBondContact O-CB 3.45Å; I118-S134 PolarHBondContact O-N 3.35Å; E132-S134 PolarHBondContact OE1-OG 3.01Å; S134-V162 CarbonylContact C-O 3.56Å; S134-V162 WeakPolarHBondContact CA-O 3.5Å; S134-V162 WeakPolarHBondContact OG-CB 3.3Å
135	I	94.2	Very high	90.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.5	175.3	-51.5	-169.3	0	0	0	108.5	I117 V133 W138 I140 L148 V162 F163 W164 V166	I117-I135 HydrophobicContact CD1-CD1 4.31Å; I117-I135 HydrophobicContact CG1-CD1 4.08Å; I117-I135 HydrophobicContact CG1-CG1 4.08Å; I117-I135 HydrophobicContact CG2-CG1 4.28Å; V133-I135 HydrophobicContact CG1-CG1 4.21Å; I135-W138 HydrophobicContact CG2-CB 4.25Å; I135-W138 HydrophobicContact CG2-CE3 3.62Å; I135-W138 HydrophobicContact CG2-CZ3 4.41Å; I135-I140 HydrophobicContact CD1-CD1 4.17Å; I135-I140 HydrophobicContact CG2-CD1 4.1Å; I135-L148 HydrophobicContact CD1-CD1 3.5Å; I135-L148 HydrophobicContact CD1-CD2 3.8Å; I135-L148 HydrophobicContact CD1-CG 4.32Å; I135-V162 PolarHBondContact N-O 2.82Å; I135-F163 HydrophobicContact CB-CD1 4.11Å; I135-F163 HydrophobicContact CB-CE1 4.47Å; I135-F163 HydrophobicContact CD1-CD1 4.44Å; I135-F163 HydrophobicContact CD1-CE1 3.98Å; I135-F163 HydrophobicContact CG1-CD1 4.43Å; I135-F163 HydrophobicContact CG1-CE1 4.31Å; I135-F163 WeakPolarHBondContact O-CA 3.25Å; I135-W164 PolarHBondContact O-N 2.8Å; I135-V166 HydrophobicContact CB-CG1 4.4Å; I135-V166 HydrophobicContact CG2-CG1 4.06Å
136	K	91	Very high	91.2	Very high	104 Å²	104	42.9 Å²	42.9	45%	0.452	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.1	-171.6	-55.7	-167.3	179	179.8	0	111.6	W138 W164	K136-W138 VanDerWaalsContact C-N 3.26Å; K136-W138 PolarHBondContact O-N 3.13Å; K136-W164 CarbonylContact C-O 3.5Å; K136-W164 WeakPolarHBondContact CA-O 3.34Å; K136-W164 HydrophobicContact CB-CB 4.21Å; K136-W164 HydrophobicContact CB-CE3 4.02Å; K136-W164 HydrophobicContact CD-CB 4.38Å; K136-W164 HydrophobicContact CG-CB 3.94Å
137	G	85.8	Confident	91.7	Very high	42 Å²	42	38 Å²	38	43%	0.433	21%	0.207	S	C	.	.	S	Bend	trans	67.2	26.6	172.1	0	0	0	0	0	113.5	W164	G137-W164 PolarHBondContact N-O 3.4Å
138	W	88.1	Confident	92.2	Very high	22 Å²	22	36 Å²	36	8%	0.083	19%	0.194	C	C	.	.			trans	-129.4	115.9	-176.7	-178.5	42.6	0	0	0	110.2	F35 P48 P115 I117 I135 K136 I140 Q144 R165 V166	F35-W138 AromaticContact CZ-CH2 3.81Å; F35-W138 HydrophobicContact CZ-CH2 3.81Å; F35-W138 HydrophobicContact CZ-CZ3 4.2Å; P48-W138 HydrophobicContact CG-CD2 3.9Å; P48-W138 HydrophobicContact CG-CE3 3.64Å; P48-W138 HydrophobicContact CG-CH2 3.63Å; P48-W138 HydrophobicContact CG-CZ2 3.83Å; P48-W138 HydrophobicContact CG-CZ3 3.51Å; P115-W138 HydrophobicContact CB-CB 3.86Å; P115-W138 HydrophobicContact CB-CD2 4.38Å; P115-W138 HydrophobicContact CB-CG 3.65Å; P115-W138 HydrophobicContact CG-CB 4.33Å; P115-W138 HydrophobicContact CG-CG 4.17Å; I117-W138 HydrophobicContact CD1-CZ3 4.24Å; I117-W138 HydrophobicContact CG1-CZ3 4.48Å; I135-W138 HydrophobicContact CG2-CB 4.25Å; I135-W138 HydrophobicContact CG2-CE3 3.62Å; I135-W138 HydrophobicContact CG2-CZ3 4.41Å; K136-W138 VanDerWaalsContact C-N 3.26Å; K136-W138 PolarHBondContact O-N 3.13Å; W138-I140 HydrophobicContact CE3-CG1 4.01Å; W138-I140 HydrophobicContact CZ3-CG1 4.23Å; W138-I140 PolarHBondContact O-N 3.35Å; W138-Q144 HydrophobicContact CH2-CB 4.19Å; W138-Q144 HydrophobicContact CH2-CG 3.99Å; W138-Q144 HydrophobicContact CZ2-CG 4.09Å; W138-Q144 VanDerWaalsContact CZ2-NE2 3.29Å; W138-R165 PolarHBondContact N-O 2.91Å; W138-V166 VanDerWaalsContact O-CA 3.23Å; W138-V166 WeakPolarHBondContact O-CA 3.34Å; W138-V166 WeakPolarHBondContact O-CB 3.31Å
139	K	90.3	Very high	92.7	Very high	152 Å²	152	32.6 Å²	32.6	66%	0.661	18%	0.179	S	C	*	.	P	Polyproline II helix	trans	-68.2	117.6	177.2	-173.5	168.7	-177.4	166.3	0	109.9	Q144 V166	K139-Q144 PolarHBondContact O-OE1 2.75Å; K139-V166 VanDerWaalsContact CA-O 3.28Å; K139-V166 WeakPolarHBondContact CA-O 3.35Å
140	I	91.8	Very high	92.9	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.015	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-92.1	125.7	-177.7	-61.7	173.4	0	0	0	109	I135 W138 Q144 L145 L148 F163 V166 F168 Q172	I135-I140 HydrophobicContact CD1-CD1 4.17Å; I135-I140 HydrophobicContact CG2-CD1 4.1Å; W138-I140 HydrophobicContact CE3-CG1 4.01Å; W138-I140 HydrophobicContact CZ3-CG1 4.23Å; W138-I140 PolarHBondContact O-N 3.35Å; I140-Q144 HydrophobicContact CG2-CB 3.82Å; I140-L145 HydrophobicContact CG2-CB 3.86Å; I140-L148 HydrophobicContact CD1-CD1 4.03Å; I140-L148 HydrophobicContact CG2-CD1 4.31Å; I140-F163 HydrophobicContact CD1-CD1 4.06Å; I140-F163 HydrophobicContact CD1-CE1 4.12Å; I140-V166 HydrophobicContact CD1-CB 3.82Å; I140-V166 HydrophobicContact CD1-CG1 3.99Å; I140-V166 HydrophobicContact CD1-CG2 4.29Å; I140-V166 HydrophobicContact CG1-CB 4.07Å; I140-V166 HydrophobicContact CG1-CG1 4.46Å; I140-V166 PolarHBondContact N-O 2.94Å; I140-F168 HydrophobicContact CD1-CE1 4.15Å; I140-F168 HydrophobicContact CD1-CZ 4.43Å; I140-Q172 PolarHBondContact O-NE2 2.87Å
141	S	92.3	Very high	92.9	Very high	52 Å²	52	36.6 Å²	36.6	36%	0.364	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-81.5	163.5	169.2	73.5	0	0	0	0	111.6	S143 Q144 L145 Q172	S141-S143 VanDerWaalsContact C-N 3.31Å; S141-S143 PolarHBondContact O-N 3Å; S141-Q144 WeakPolarHBondContact O-CB 3.17Å; S141-Q144 PolarHBondContact O-N 2.87Å; S141-Q144 WeakPolarHBondContact OG-CG 3.07Å; S141-Q144 PolarHBondContact OG-N 2.05Å; S141-Q144 PolarHBondContact OG-OE1 3.16Å; S141-L145 PolarHBondContact O-N 2.79Å; S141-Q172 VanDerWaalsContact C-NE2 3.27Å
142	N	92.3	Very high	92.9	Very high	57 Å²	57	35.2 Å²	35.2	31%	0.305	19%	0.187	S	C	.	.	H	α-helix	trans	-55	-46.6	177.2	-68.9	-2	0	0	0	111.6	Q144 L145 D146 E171 Q172	N142-Q144 VanDerWaalsContact C-N 3.29Å; N142-Q144 PolarHBondContact O-N 3.27Å; N142-L145 PolarHBondContact O-N 3.06Å; N142-L145 VanDerWaalsContact O-N 3.09Å; N142-D146 PolarHBondContact O-N 3.21Å; N142-E171 PolarHBondContact ND2-OE2 2.88Å; N142-Q172 VanDerWaalsContact OD1-CD 3.3Å; N142-Q172 WeakPolarHBondContact OD1-CG 3.33Å; N142-Q172 PolarHBondContact OD1-NE2 3.23Å
143	S	92.1	Very high	92.8	Very high	58 Å²	58	37.3 Å²	37.3	41%	0.406	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-33.3	177.4	-45.8	0	0	0	0	113.3	S141 V147	S141-S143 VanDerWaalsContact C-N 3.31Å; S141-S143 PolarHBondContact O-N 3Å; S143-V147 WeakPolarHBondContact O-CG2 2.95Å; S143-V147 PolarHBondContact O-N 2.95Å
144	Q	92.3	Very high	92.5	Very high	17 Å²	17	40.4 Å²	40.4	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-70.4	-40	174.3	-75.4	163.5	-11.4	0	0	111.2	V44 H46 W138 K139 I140 S141 N142 V147 L148	V44-Q144 HydrophobicContact CG1-CG 3.5Å; V44-Q144 HydrophobicContact CG2-CG 4.36Å; H46-Q144 PolarHBondContact O-NE2 2.72Å; H46-Q144 VanDerWaalsContact O-NE2 3.12Å; W138-Q144 HydrophobicContact CH2-CB 4.19Å; W138-Q144 HydrophobicContact CH2-CG 3.99Å; W138-Q144 HydrophobicContact CZ2-CG 4.09Å; W138-Q144 VanDerWaalsContact CZ2-NE2 3.29Å; K139-Q144 PolarHBondContact O-OE1 2.75Å; I140-Q144 HydrophobicContact CG2-CB 3.82Å; S141-Q144 WeakPolarHBondContact O-CB 3.17Å; S141-Q144 PolarHBondContact O-N 2.87Å; S141-Q144 WeakPolarHBondContact OG-CG 3.07Å; S141-Q144 PolarHBondContact OG-N 2.05Å; S141-Q144 PolarHBondContact OG-OE1 3.16Å; N142-Q144 VanDerWaalsContact C-N 3.29Å; N142-Q144 PolarHBondContact O-N 3.27Å; Q144-V147 PolarHBondContact O-N 3.26Å; Q144-L148 WeakPolarHBondContact O-CB 3.37Å; Q144-L148 VanDerWaalsContact O-CG 3.25Å; Q144-L148 WeakPolarHBondContact O-CG 3.42Å; Q144-L148 PolarHBondContact O-N 2.88Å
145	L	95	Very high	92.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-40.1	175.3	-175.2	57.4	0	0	0	111.6	I140 S141 N142 V147 L148 I149 F168 Q172 Q175	I140-L145 HydrophobicContact CG2-CB 3.86Å; S141-L145 PolarHBondContact O-N 2.79Å; N142-L145 PolarHBondContact O-N 3.06Å; N142-L145 VanDerWaalsContact O-N 3.09Å; L145-V147 VanDerWaalsContact C-N 3.34Å; L145-V147 PolarHBondContact O-N 2.92Å; L145-L148 PolarHBondContact O-N 3.39Å; L145-I149 HydrophobicContact CD1-CD1 4.13Å; L145-I149 HydrophobicContact CD1-CG1 4.21Å; L145-I149 HydrophobicContact CG-CD1 3.91Å; L145-I149 HydrophobicContact CG-CG1 4.41Å; L145-I149 WeakPolarHBondContact O-CB 3.34Å; L145-I149 WeakPolarHBondContact O-CG1 3.48Å; L145-I149 PolarHBondContact O-N 3.28Å; L145-F168 HydrophobicContact CD1-CE1 4.15Å; L145-F168 HydrophobicContact CD1-CZ 4.42Å; L145-F168 HydrophobicContact CD2-CE1 4.13Å; L145-Q172 HydrophobicContact CD2-CB 3.61Å; L145-Q172 HydrophobicContact CD2-CG 3.85Å; L145-Q175 HydrophobicContact CD2-CB 4.42Å
146	D	94.2	Very high	92.1	Very high	67 Å²	67	45.5 Å²	45.5	36%	0.358	25%	0.252	S	S	.	.	H	α-helix	trans	-55.5	-49.1	172.9	-72.9	-42.5	0	0	0	111.6	N142 I149 K150 Q175	N142-D146 PolarHBondContact O-N 3.21Å; D146-I149 PolarHBondContact O-N 3.24Å; D146-K150 WeakPolarHBondContact O-CG 3.36Å; D146-K150 PolarHBondContact O-N 3Å; D146-Q175 PolarHBondContact OD1-NE2 3.01Å
147	V	93.4	Very high	92.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-45.7	177.9	166.8	0	0	0	0	110.6	F35 L38 S42 V44 S143 Q144 L145 K150 C151	F35-V147 HydrophobicContact CD2-CG1 3.73Å; F35-V147 HydrophobicContact CE2-CG1 3.96Å; L38-V147 HydrophobicContact CB-CB 4.45Å; L38-V147 HydrophobicContact CB-CG1 3.65Å; L38-V147 HydrophobicContact CB-CG2 4.23Å; S42-V147 WeakPolarHBondContact OG-CG2 3.35Å; V44-V147 HydrophobicContact CG2-CG2 4.44Å; S143-V147 WeakPolarHBondContact O-CG2 2.95Å; S143-V147 PolarHBondContact O-N 2.95Å; Q144-V147 PolarHBondContact O-N 3.26Å; L145-V147 VanDerWaalsContact C-N 3.34Å; L145-V147 PolarHBondContact O-N 2.92Å; V147-K150 PolarHBondContact O-N 3.45Å; V147-C151 PolarHBondContact O-N 3.3Å; V147-C151 PolarHBondContact O-SG 2.84Å
148	L	94.6	Very high	92.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-45.7	177.8	-73.9	169.2	0	0	0	111.9	F35 I117 I135 I140 Q144 L145 K150 C151 F152	F35-L148 HydrophobicContact CD2-CD2 3.71Å; F35-L148 HydrophobicContact CD2-CG 4.34Å; F35-L148 HydrophobicContact CE2-CD2 3.58Å; F35-L148 HydrophobicContact CE2-CG 3.92Å; I117-L148 HydrophobicContact CD1-CD2 3.97Å; I135-L148 HydrophobicContact CD1-CD1 3.5Å; I135-L148 HydrophobicContact CD1-CD2 3.8Å; I135-L148 HydrophobicContact CD1-CG 4.32Å; I140-L148 HydrophobicContact CD1-CD1 4.03Å; I140-L148 HydrophobicContact CG2-CD1 4.31Å; Q144-L148 WeakPolarHBondContact O-CB 3.37Å; Q144-L148 VanDerWaalsContact O-CG 3.25Å; Q144-L148 WeakPolarHBondContact O-CG 3.42Å; Q144-L148 PolarHBondContact O-N 2.88Å; L145-L148 PolarHBondContact O-N 3.39Å; L148-K150 VanDerWaalsContact C-N 3.32Å; L148-K150 PolarHBondContact O-N 2.85Å; L148-C151 WeakPolarHBondContact O-CA 3.45Å; L148-C151 WeakPolarHBondContact O-CB 3.5Å; L148-C151 PolarHBondContact O-N 3.43Å; L148-C151 VanDerWaalsContact O-N 3.1Å; L148-F152 HydrophobicContact CB-CE1 4.4Å; L148-F152 HydrophobicContact CB-CE2 3.82Å; L148-F152 HydrophobicContact CB-CZ 3.77Å; L148-F152 HydrophobicContact CD2-CE1 4.22Å; L148-F152 HydrophobicContact CD2-CZ 3.94Å; L148-F152 HydrophobicContact CG-CZ 4.32Å; L148-F152 VanDerWaalsContact O-CD1 3.3Å; L148-F152 WeakPolarHBondContact O-CD1 3.47Å; L148-F152 WeakPolarHBondContact O-CD2 3.19Å; L148-F152 WeakPolarHBondContact O-CG 3.28Å; L148-F152 PolarHBondContact O-N 2.88Å
149	I	95.5	Very high	93	Very high	22 Å²	22	44.9 Å²	44.9	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-41.1	178.1	-76.3	171.7	0	0	0	111.1	L145 D146 C151 F152 S153 Q175 F179	L145-I149 HydrophobicContact CD1-CD1 4.13Å; L145-I149 HydrophobicContact CD1-CG1 4.21Å; L145-I149 HydrophobicContact CG-CD1 3.91Å; L145-I149 HydrophobicContact CG-CG1 4.41Å; L145-I149 WeakPolarHBondContact O-CB 3.34Å; L145-I149 WeakPolarHBondContact O-CG1 3.48Å; L145-I149 PolarHBondContact O-N 3.28Å; D146-I149 PolarHBondContact O-N 3.24Å; I149-C151 VanDerWaalsContact C-N 3.33Å; I149-C151 PolarHBondContact O-N 3.12Å; I149-F152 PolarHBondContact O-N 3.17Å; I149-S153 WeakPolarHBondContact O-CB 3.45Å; I149-S153 PolarHBondContact O-N 3.04Å; I149-S153 PolarHBondContact O-OG 3.41Å; I149-Q175 HydrophobicContact CD1-CG 3.77Å; I149-F179 HydrophobicContact CD1-CB 4.1Å; I149-F179 HydrophobicContact CG1-CB 4.28Å; I149-F179 HydrophobicContact CG1-CD1 4.5Å; I149-F179 HydrophobicContact CG1-CG 4.23Å; I149-F179 HydrophobicContact CG2-CB 4.09Å; I149-F179 HydrophobicContact CG2-CD2 3.67Å; I149-F179 HydrophobicContact CG2-CE2 4.35Å; I149-F179 HydrophobicContact CG2-CG 3.96Å
150	K	93.3	Very high	93.4	Very high	101 Å²	101	40.6 Å²	40.6	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-60.2	-43.1	173.6	-72.2	172.7	-176	177.5	0	111.6	L38 D146 V147 L148 S153	L38-K150 HydrophobicContact CD1-CB 3.81Å; L38-K150 HydrophobicContact CD2-CD 4.4Å; D146-K150 WeakPolarHBondContact O-CG 3.36Å; D146-K150 PolarHBondContact O-N 3Å; V147-K150 PolarHBondContact O-N 3.45Å; L148-K150 VanDerWaalsContact C-N 3.32Å; L148-K150 PolarHBondContact O-N 2.85Å; K150-S153 PolarHBondContact O-N 3.3Å
151	C	92.9	Very high	93.7	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-45.4	175.5	-59.5	0	0	0	0	111.6	L31 V147 L148 I149 S153 V154 A155	L31-C151 HydrophobicContact CD1-CB 3.56Å; L31-C151 HydrophobicContact CG-CB 4.42Å; V147-C151 PolarHBondContact O-N 3.3Å; V147-C151 PolarHBondContact O-SG 2.84Å; L148-C151 WeakPolarHBondContact O-CA 3.45Å; L148-C151 WeakPolarHBondContact O-CB 3.5Å; L148-C151 PolarHBondContact O-N 3.43Å; L148-C151 VanDerWaalsContact O-N 3.1Å; I149-C151 VanDerWaalsContact C-N 3.33Å; I149-C151 PolarHBondContact O-N 3.12Å; C151-S153 VanDerWaalsContact C-N 3.27Å; C151-S153 PolarHBondContact O-N 2.72Å; C151-V154 PolarHBondContact O-N 3.38Å; C151-A155 PolarHBondContact O-N 3.35Å
152	F	94.7	Very high	94	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-31.6	-179.8	-57.9	-21.5	0	0	0	112.6	L31 V133 L148 I149 V154 A155 L158 L161 F163 F179	L31-F152 HydrophobicContact CD1-CD1 4.18Å; L31-F152 HydrophobicContact CD1-CE1 4.41Å; V133-F152 HydrophobicContact CB-CE1 4.14Å; V133-F152 HydrophobicContact CG1-CE1 3.91Å; V133-F152 HydrophobicContact CG1-CZ 4.2Å; V133-F152 HydrophobicContact CG2-CE1 4.05Å; L148-F152 HydrophobicContact CB-CE1 4.4Å; L148-F152 HydrophobicContact CB-CE2 3.82Å; L148-F152 HydrophobicContact CB-CZ 3.77Å; L148-F152 HydrophobicContact CD2-CE1 4.22Å; L148-F152 HydrophobicContact CD2-CZ 3.94Å; L148-F152 HydrophobicContact CG-CZ 4.32Å; L148-F152 VanDerWaalsContact O-CD1 3.3Å; L148-F152 WeakPolarHBondContact O-CD1 3.47Å; L148-F152 WeakPolarHBondContact O-CD2 3.19Å; L148-F152 WeakPolarHBondContact O-CG 3.28Å; L148-F152 PolarHBondContact O-N 2.88Å; I149-F152 PolarHBondContact O-N 3.17Å; F152-V154 PolarHBondContact O-N 2.79Å; F152-A155 PolarHBondContact O-N 2.94Å; F152-L158 HydrophobicContact CB-CD2 3.89Å; F152-L158 HydrophobicContact CD1-CD2 3.55Å; F152-L158 HydrophobicContact CE1-CD2 4.35Å; F152-L158 HydrophobicContact CG-CD2 3.86Å; F152-L161 HydrophobicContact CD1-CD2 4.32Å; F152-L161 HydrophobicContact CD2-CD1 4.2Å; F152-L161 HydrophobicContact CD2-CD2 4.11Å; F152-L161 HydrophobicContact CE1-CD2 4.1Å; F152-L161 HydrophobicContact CE2-CD1 4.26Å; F152-L161 HydrophobicContact CE2-CD2 3.86Å; F152-L161 HydrophobicContact CG-CD2 4.34Å; F152-L161 HydrophobicContact CZ-CD2 3.85Å; F152-F163 HydrophobicContact CE2-CZ 4.17Å; F152-F179 HydrophobicContact CB-CE1 4.11Å; F152-F179 HydrophobicContact CB-CE2 4.25Å; F152-F179 HydrophobicContact CB-CZ 3.56Å; F152-F179 HydrophobicContact CD2-CE1 4.32Å
153	S	92.3	Very high	94.2	Very high	72 Å²	72	36 Å²	36	50%	0.503	20%	0.197	S	C	.	.	H	α-helix	trans	-65.5	-26.9	179.7	-60.3	0	0	0	0	113.1	I149 K150 C151 F179	I149-S153 WeakPolarHBondContact O-CB 3.45Å; I149-S153 PolarHBondContact O-N 3.04Å; I149-S153 PolarHBondContact O-OG 3.41Å; K150-S153 PolarHBondContact O-N 3.3Å; C151-S153 VanDerWaalsContact C-N 3.27Å; C151-S153 PolarHBondContact O-N 2.72Å; S153-F179 WeakPolarHBondContact OG-CE2 3.4Å
154	V	90.5	Very high	94.4	Very high	66 Å²	66	38.5 Å²	38.5	40%	0.4	20%	0.198	S	C	.	.	H	α-helix	trans	-93.8	-20.8	179.1	-175	0	0	0	0	112.1	V27 C151 F152 N156	V27-V154 HydrophobicContact CB-CG2 4.21Å; V27-V154 HydrophobicContact CG1-CB 3.95Å; V27-V154 HydrophobicContact CG1-CG1 4.17Å; V27-V154 HydrophobicContact CG1-CG2 3.55Å; C151-V154 PolarHBondContact O-N 3.38Å; F152-V154 PolarHBondContact O-N 2.79Å; V154-N156 PolarHBondContact O-N 2.87Å
155	A	91.5	Very high	94.4	Very high	11 Å²	11	45.6 Å²	45.6	9%	0.091	22%	0.224	C	C	.	.			trans	-75.9	81.5	179.4	0	0	0	0	0	112.1	C151 F152 K157 L158	C151-A155 PolarHBondContact O-N 3.35Å; F152-A155 PolarHBondContact O-N 2.94Å; A155-K157 PolarHBondContact O-N 3.05Å; A155-K157 VanDerWaalsContact O-N 3.13Å; A155-L158 HydrophobicContact CB-CB 3.73Å; A155-L158 HydrophobicContact CB-CD2 4.14Å; A155-L158 VanDerWaalsContact O-CB 3.23Å; A155-L158 WeakPolarHBondContact O-CB 3.23Å; A155-L158 PolarHBondContact O-N 3.25Å
156	N	89.4	Confident	94.3	Very high	106 Å²	106	45.6 Å²	45.6	57%	0.567	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.9	-174	66.3	0.3	0	0	0	115.9	V154 T185	V154-N156 PolarHBondContact O-N 2.87Å; N156-T185 WeakPolarHBondContact O-CG2 3.32Å
157	K	92.9	Very high	94.2	Very high	107 Å²	107	43 Å²	43	47%	0.465	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-7.9	173.7	-64.4	-59.3	-176.9	174.7	0	113.5	V130 N131 A155 S159	V130-K157 CarbonylContact O-C 3.57Å; V130-K157 VanDerWaalsContact O-C 3.22Å; N131-K157 WeakPolarHBondContact CA-O 3.39Å; A155-K157 PolarHBondContact O-N 3.05Å; A155-K157 VanDerWaalsContact O-N 3.13Å; K157-S159 PolarHBondContact O-N 3.06Å; K157-S159 VanDerWaalsContact O-N 3.14Å
158	L	95.6	Very high	94.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.			trans	-65.7	118.3	-178.1	-175.3	57	0	0	0	109	V130 V133 F152 A155 K160 L161 T185 I186	V130-L158 HydrophobicContact CG1-CD1 4.27Å; V130-L158 WeakPolarHBondContact O-CA 3.47Å; V130-L158 PolarHBondContact O-N 3.49Å; V130-L158 VanDerWaalsContact O-N 3.09Å; V133-L158 HydrophobicContact CB-CD1 4.29Å; V133-L158 HydrophobicContact CG2-CD1 3.71Å; V133-L158 HydrophobicContact CG2-CD2 4.11Å; F152-L158 HydrophobicContact CB-CD2 3.89Å; F152-L158 HydrophobicContact CD1-CD2 3.55Å; F152-L158 HydrophobicContact CE1-CD2 4.35Å; F152-L158 HydrophobicContact CG-CD2 3.86Å; A155-L158 HydrophobicContact CB-CB 3.73Å; A155-L158 HydrophobicContact CB-CD2 4.14Å; A155-L158 VanDerWaalsContact O-CB 3.23Å; A155-L158 WeakPolarHBondContact O-CB 3.23Å; A155-L158 PolarHBondContact O-N 3.25Å; L158-K160 WeakPolarHBondContact CD1-O 3.48Å; L158-L161 HydrophobicContact CD1-CD2 4.42Å; L158-L161 HydrophobicContact CD2-CD2 3.94Å; L158-L161 HydrophobicContact CG-CD2 4.39Å; L158-T185 CarbonylContact O-C 3.44Å; L158-T185 WeakPolarHBondContact O-CB 3.44Å; L158-T185 PolarHBondContact O-OG1 2.71Å; L158-I186 HydrophobicContact CB-CD1 4.24Å; L158-I186 HydrophobicContact CD2-CD1 4.09Å; L158-I186 HydrophobicContact CG-CD1 3.62Å; L158-I186 WeakPolarHBondContact O-CD1 3.26Å
159	S	96.7	Very high	94.4	Very high	47 Å²	47	45.9 Å²	45.9	33%	0.329	23%	0.23	S	C	.	.			trans	-122	-16.5	-177.6	64.7	0	0	0	0	112.9	N131 K157 T185 K187 S188	N131-S159 PolarHBondContact O-N 2.93Å; N131-S159 PolarHBondContact O-OG 3.39Å; K157-S159 PolarHBondContact O-N 3.06Å; K157-S159 VanDerWaalsContact O-N 3.14Å; S159-T185 WeakPolarHBondContact CA-O 3.06Å; S159-K187 PolarHBondContact O-N 2.51Å; S159-S188 PolarHBondContact O-N 3.26Å
160	K	97.9	Very high	94.5	Very high	62 Å²	62	46 Å²	46	27%	0.27	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.4	-174.8	-175.7	170.6	165.1	-150.4	0	112.8	N131 E132 V133 L158 V162 S188	N131-K160 PolarHBondContact O-N 3.06Å; E132-K160 VanDerWaalsContact CA-O 3.28Å; E132-K160 WeakPolarHBondContact CA-O 3.23Å; E132-K160 HydrophobicContact CB-CB 4.04Å; E132-K160 HydrophobicContact CB-CD 4.49Å; E132-K160 HydrophobicContact CB-CG 4.41Å; E132-K160 VanDerWaalsContact CD-CE 3.46Å; E132-K160 HydrophobicContact CG-CB 4.1Å; E132-K160 HydrophobicContact CG-CD 4.04Å; E132-K160 HydrophobicContact CG-CG 3.94Å; E132-K160 WeakPolarHBondContact OE1-CE 3.44Å; E132-K160 IonicContact OE1-NZ 2.72Å; E132-K160 PolarHBondContact OE1-NZ 3.3Å; E132-K160 VanDerWaalsContact OE2-CD 3.31Å; E132-K160 WeakPolarHBondContact OE2-CD 3.38Å; E132-K160 WeakPolarHBondContact OE2-CE 3.36Å; E132-K160 IonicContact OE2-NZ 3.01Å; E132-K160 PolarHBondContact OE2-NZ 3.14Å; V133-K160 PolarHBondContact N-O 2.96Å; L158-K160 WeakPolarHBondContact CD1-O 3.48Å; K160-V162 HydrophobicContact CG-CG2 4.15Å; K160-S188 CarbonylContact C-O 3.54Å; K160-S188 VanDerWaalsContact CA-O 3.3Å; K160-S188 WeakPolarHBondContact CA-O 3.26Å
161	L	98.1	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.2	171.8	-66.1	175.3	0	0	0	109.7	V133 F152 L158 F163 L176 F179 I186 S188 L189 T190	V133-L161 HydrophobicContact CB-CD2 4.02Å; F152-L161 HydrophobicContact CD1-CD2 4.32Å; F152-L161 HydrophobicContact CD2-CD1 4.2Å; F152-L161 HydrophobicContact CD2-CD2 4.11Å; F152-L161 HydrophobicContact CE1-CD2 4.1Å; F152-L161 HydrophobicContact CE2-CD1 4.26Å; F152-L161 HydrophobicContact CE2-CD2 3.86Å; F152-L161 HydrophobicContact CG-CD2 4.34Å; F152-L161 HydrophobicContact CZ-CD2 3.85Å; L158-L161 HydrophobicContact CD1-CD2 4.42Å; L158-L161 HydrophobicContact CD2-CD2 3.94Å; L158-L161 HydrophobicContact CG-CD2 4.39Å; L161-F163 HydrophobicContact CB-CD2 4.48Å; L161-F163 HydrophobicContact CB-CE2 3.82Å; L161-F163 HydrophobicContact CB-CZ 4.37Å; L161-F163 HydrophobicContact CD1-CE2 4.21Å; L161-F163 HydrophobicContact CD1-CZ 4.43Å; L161-L176 HydrophobicContact CD1-CD1 4.48Å; L161-F179 HydrophobicContact CD1-CE1 4.45Å; L161-I186 HydrophobicContact CD1-CD1 4.11Å; L161-I186 HydrophobicContact CD1-CG1 4.38Å; L161-I186 HydrophobicContact CD1-CG2 4.44Å; L161-I186 HydrophobicContact CG-CD1 3.97Å; L161-S188 PolarHBondContact N-O 2.99Å; L161-L189 HydrophobicContact CB-CD1 3.83Å; L161-T190 PolarHBondContact O-N 3.13Å
162	V	97.7	Very high	94.8	Very high	14 Å²	14	47.2 Å²	47.2	9%	0.085	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	113.2	177.8	-179.5	0	0	0	0	109.4	E132 V133 S134 I135 K160 T190	E132-V162 HydrophobicContact CG-CG2 4.47Å; V133-V162 PolarHBondContact O-N 2.87Å; S134-V162 CarbonylContact C-O 3.56Å; S134-V162 WeakPolarHBondContact CA-O 3.5Å; S134-V162 WeakPolarHBondContact OG-CB 3.3Å; I135-V162 PolarHBondContact N-O 2.82Å; K160-V162 HydrophobicContact CG-CG2 4.15Å; V162-T190 HydrophobicContact CG1-CG2 4.1Å
163	F	97	Very high	95	Very high	1 Å²	1	47.2 Å²	47.2	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.1	173.3	-58.5	-74.7	0	0	0	108.6	I135 I140 F152 L161 V166 F168 L176 L189 T190 I191 D192	I135-F163 HydrophobicContact CB-CD1 4.11Å; I135-F163 HydrophobicContact CB-CE1 4.47Å; I135-F163 HydrophobicContact CD1-CD1 4.44Å; I135-F163 HydrophobicContact CD1-CE1 3.98Å; I135-F163 HydrophobicContact CG1-CD1 4.43Å; I135-F163 HydrophobicContact CG1-CE1 4.31Å; I135-F163 WeakPolarHBondContact O-CA 3.25Å; I140-F163 HydrophobicContact CD1-CD1 4.06Å; I140-F163 HydrophobicContact CD1-CE1 4.12Å; F152-F163 HydrophobicContact CE2-CZ 4.17Å; L161-F163 HydrophobicContact CB-CD2 4.48Å; L161-F163 HydrophobicContact CB-CE2 3.82Å; L161-F163 HydrophobicContact CB-CZ 4.37Å; L161-F163 HydrophobicContact CD1-CE2 4.21Å; L161-F163 HydrophobicContact CD1-CZ 4.43Å; F163-V166 HydrophobicContact CB-CG1 4.01Å; F163-V166 HydrophobicContact CB-CG2 3.79Å; F163-V166 HydrophobicContact CD1-CG1 4.21Å; F163-V166 HydrophobicContact CD1-CG2 4.35Å; F163-V166 HydrophobicContact CG-CG2 4.36Å; F163-F168 HydrophobicContact CB-CE2 4.02Å; F163-F168 HydrophobicContact CD1-CE2 4.16Å; F163-F168 AromaticContact CD1-CZ 3.82Å; F163-F168 HydrophobicContact CD1-CZ 3.82Å; F163-F168 AromaticContact CD2-CE2 3.8Å; F163-F168 HydrophobicContact CD2-CE2 3.8Å; F163-F168 HydrophobicContact CD2-CZ 4.04Å; F163-F168 AromaticContact CE1-CZ 3.95Å; F163-F168 HydrophobicContact CE1-CZ 3.95Å; F163-F168 HydrophobicContact CE2-CE2 4.27Å; F163-F168 HydrophobicContact CE2-CZ 4.15Å; F163-F168 AromaticContact CG-CE2 3.73Å; F163-F168 HydrophobicContact CG-CE2 3.73Å; F163-F168 AromaticContact CG-CZ 3.87Å; F163-F168 HydrophobicContact CG-CZ 3.87Å; F163-F168 HydrophobicContact CZ-CZ 4.12Å; F163-L176 HydrophobicContact CE2-CD2 4.17Å; F163-L189 HydrophobicContact CD2-CD1 3.91Å; F163-L189 HydrophobicContact CE2-CD1 3.87Å; F163-T190 PolarHBondContact N-O 3.45Å; F163-I191 HydrophobicContact CB-CG1 4.37Å; F163-I191 HydrophobicContact CD2-CG1 4.1Å; F163-I191 CarbonylContact O-C 3.45Å; F163-I191 WeakPolarHBondContact O-CA 3.37Å; F163-D192 PolarHBondContact O-N 2.95Å
164	W	95.7	Very high	95.2	Very high	112 Å²	112	46.6 Å²	46.6	42%	0.424	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.5	174.8	179.8	85	0	0	0	109.3	I135 K136 G137 V166 D192	I135-W164 PolarHBondContact O-N 2.8Å; K136-W164 CarbonylContact C-O 3.5Å; K136-W164 WeakPolarHBondContact CA-O 3.34Å; K136-W164 HydrophobicContact CB-CB 4.21Å; K136-W164 HydrophobicContact CB-CE3 4.02Å; K136-W164 HydrophobicContact CD-CB 4.38Å; K136-W164 HydrophobicContact CG-CB 3.94Å; G137-W164 PolarHBondContact N-O 3.4Å; W164-V166 PolarHBondContact O-N 2.83Å; W164-D192 CarbonylContact C-O 3.4Å; W164-D192 WeakPolarHBondContact CA-O 3.47Å
165	R	93.3	Very high	95.6	Very high	165 Å²	165	45.7 Å²	45.7	62%	0.623	23%	0.227	S	C	*	.	S	Bend	trans	50.5	57.6	178.7	-165.4	-177.4	168.2	111.7	-0.4	112	W138 D192 A193	W138-R165 PolarHBondContact N-O 2.91Å; R165-D192 PolarHBondContact N-O 3.03Å; R165-A193 WeakPolarHBondContact CA-O 3.44Å; R165-A193 HydrophobicContact CB-CB 4.26Å; R165-A193 WeakPolarHBondContact CB-O 3.3Å
166	V	93.3	Very high	95.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.222	C	C	.	.			trans	-102.9	-1.3	-178.2	-59.8	0	0	0	0	113.7	I135 W138 K139 I140 F163 W164 F168 N194	I135-V166 HydrophobicContact CB-CG1 4.4Å; I135-V166 HydrophobicContact CG2-CG1 4.06Å; W138-V166 VanDerWaalsContact O-CA 3.23Å; W138-V166 WeakPolarHBondContact O-CA 3.34Å; W138-V166 WeakPolarHBondContact O-CB 3.31Å; K139-V166 VanDerWaalsContact CA-O 3.28Å; K139-V166 WeakPolarHBondContact CA-O 3.35Å; I140-V166 HydrophobicContact CD1-CB 3.82Å; I140-V166 HydrophobicContact CD1-CG1 3.99Å; I140-V166 HydrophobicContact CD1-CG2 4.29Å; I140-V166 HydrophobicContact CG1-CB 4.07Å; I140-V166 HydrophobicContact CG1-CG1 4.46Å; I140-V166 PolarHBondContact N-O 2.94Å; F163-V166 HydrophobicContact CB-CG1 4.01Å; F163-V166 HydrophobicContact CB-CG2 3.79Å; F163-V166 HydrophobicContact CD1-CG1 4.21Å; F163-V166 HydrophobicContact CD1-CG2 4.35Å; F163-V166 HydrophobicContact CG-CG2 4.36Å; W164-V166 PolarHBondContact O-N 2.83Å; V166-F168 HydrophobicContact CG2-CD1 3.94Å; V166-F168 HydrophobicContact CG2-CD2 3.62Å; V166-F168 HydrophobicContact CG2-CE1 4Å; V166-F168 HydrophobicContact CG2-CE2 3.69Å; V166-F168 HydrophobicContact CG2-CG 3.75Å; V166-F168 HydrophobicContact CG2-CZ 3.88Å; V166-F168 PolarHBondContact O-N 3.36Å; V166-N194 WeakPolarHBondContact CG2-OD1 3.41Å; V166-N194 PolarHBondContact N-OD1 3.29Å
167	G	92.6	Very high	96.2	Very high	13 Å²	13	40.5 Å²	40.5	13%	0.134	20%	0.198	C	C	.	.			trans	63.8	40.1	174.6	0	0	0	0	0	112.7	N194	G167-N194 PolarHBondContact N-OD1 2.89Å
168	F	95.5	Very high	96.5	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.013	20%	0.202	C	C	.	.			trans	-59.9	142.4	178.3	-82.2	-34.8	0	0	0	111.6	I140 L145 F163 V166 Q172 I173 L176 I191 L197	I140-F168 HydrophobicContact CD1-CE1 4.15Å; I140-F168 HydrophobicContact CD1-CZ 4.43Å; L145-F168 HydrophobicContact CD1-CE1 4.15Å; L145-F168 HydrophobicContact CD1-CZ 4.42Å; L145-F168 HydrophobicContact CD2-CE1 4.13Å; F163-F168 HydrophobicContact CB-CE2 4.02Å; F163-F168 HydrophobicContact CD1-CE2 4.16Å; F163-F168 AromaticContact CD1-CZ 3.82Å; F163-F168 HydrophobicContact CD1-CZ 3.82Å; F163-F168 AromaticContact CD2-CE2 3.8Å; F163-F168 HydrophobicContact CD2-CE2 3.8Å; F163-F168 HydrophobicContact CD2-CZ 4.04Å; F163-F168 AromaticContact CE1-CZ 3.95Å; F163-F168 HydrophobicContact CE1-CZ 3.95Å; F163-F168 HydrophobicContact CE2-CE2 4.27Å; F163-F168 HydrophobicContact CE2-CZ 4.15Å; F163-F168 AromaticContact CG-CE2 3.73Å; F163-F168 HydrophobicContact CG-CE2 3.73Å; F163-F168 AromaticContact CG-CZ 3.87Å; F163-F168 HydrophobicContact CG-CZ 3.87Å; F163-F168 HydrophobicContact CZ-CZ 4.12Å; V166-F168 HydrophobicContact CG2-CD1 3.94Å; V166-F168 HydrophobicContact CG2-CD2 3.62Å; V166-F168 HydrophobicContact CG2-CE1 4Å; V166-F168 HydrophobicContact CG2-CE2 3.69Å; V166-F168 HydrophobicContact CG2-CG 3.75Å; V166-F168 HydrophobicContact CG2-CZ 3.88Å; V166-F168 PolarHBondContact O-N 3.36Å; F168-Q172 HydrophobicContact CD1-CB 3.85Å; F168-Q172 HydrophobicContact CE1-CB 4.49Å; F168-Q172 HydrophobicContact CG-CB 4.47Å; F168-I173 HydrophobicContact CB-CD1 4.01Å; F168-I173 HydrophobicContact CB-CG1 4.3Å; F168-I173 HydrophobicContact CD2-CD1 3.68Å; F168-I173 HydrophobicContact CE2-CD1 4.42Å; F168-I173 HydrophobicContact CG-CD1 4.09Å; F168-L176 HydrophobicContact CE2-CD2 4.22Å; F168-L176 HydrophobicContact CZ-CD2 4.44Å; F168-I191 HydrophobicContact CD2-CD1 4.13Å; F168-I191 HydrophobicContact CD2-CG2 4.04Å; F168-I191 HydrophobicContact CE2-CD1 4.03Å; F168-I191 HydrophobicContact CE2-CG1 4.24Å; F168-I191 HydrophobicContact CE2-CG2 4.5Å; F168-L197 WeakPolarHBondContact O-CD2 3.44Å
169	T	96.2	Very high	96.5	Very high	59 Å²	59	39.6 Å²	39.6	36%	0.362	20%	0.204	S	C	.	.			trans	-96.6	167.6	167.6	69.5	0	0	0	0	111.1	E171 Q172 I173	T169-E171 VanDerWaalsContact C-N 3.27Å; T169-E171 PolarHBondContact O-N 3.44Å; T169-Q172 PolarHBondContact O-N 3.38Å; T169-Q172 VanDerWaalsContact O-N 3.15Å; T169-Q172 WeakPolarHBondContact OG1-CG 3.1Å; T169-Q172 PolarHBondContact OG1-N 2.97Å; T169-I173 PolarHBondContact O-N 2.94Å
170	A	96.5	Very high	96.6	Very high	25 Å²	25	37.5 Å²	37.5	21%	0.207	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-36.6	175.4	0	0	0	0	0	112.6	I173 T174 S201	A170-I173 PolarHBondContact O-N 3.17Å; A170-T174 PolarHBondContact O-N 3.29Å; A170-T174 PolarHBondContact O-OG1 2.91Å; A170-S201 WeakPolarHBondContact CB-OG 3.47Å
171	E	96.9	Very high	96.5	Very high	124 Å²	124	36.6 Å²	36.6	58%	0.579	19%	0.191	S	C	*	.	H	α-helix	trans	-61.9	-44	174.2	-174.5	-174.6	-167.5	0	0	111.3	N142 T169 T174 Q175	N142-E171 PolarHBondContact ND2-OE2 2.88Å; T169-E171 VanDerWaalsContact C-N 3.27Å; T169-E171 PolarHBondContact O-N 3.44Å; E171-T174 WeakPolarHBondContact O-CB 3.39Å; E171-T174 PolarHBondContact O-N 3.3Å; E171-Q175 WeakPolarHBondContact O-CB 3.48Å; E171-Q175 PolarHBondContact O-N 2.85Å
172	Q	97.1	Very high	96.3	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.019	23%	0.225	C	C	.	.	H	α-helix	trans	-67.4	-36.7	178.5	-71.2	174.5	-27.4	0	0	112.6	I140 S141 N142 L145 F168 T169 T174 Q175 L176	I140-Q172 PolarHBondContact O-NE2 2.87Å; S141-Q172 VanDerWaalsContact C-NE2 3.27Å; N142-Q172 VanDerWaalsContact OD1-CD 3.3Å; N142-Q172 WeakPolarHBondContact OD1-CG 3.33Å; N142-Q172 PolarHBondContact OD1-NE2 3.23Å; L145-Q172 HydrophobicContact CD2-CB 3.61Å; L145-Q172 HydrophobicContact CD2-CG 3.85Å; F168-Q172 HydrophobicContact CD1-CB 3.85Å; F168-Q172 HydrophobicContact CE1-CB 4.49Å; F168-Q172 HydrophobicContact CG-CB 4.47Å; T169-Q172 PolarHBondContact O-N 3.38Å; T169-Q172 VanDerWaalsContact O-N 3.15Å; T169-Q172 WeakPolarHBondContact OG1-CG 3.1Å; T169-Q172 PolarHBondContact OG1-N 2.97Å; Q172-T174 VanDerWaalsContact C-N 3.35Å; Q172-Q175 PolarHBondContact O-N 3.12Å; Q172-L176 WeakPolarHBondContact O-CB 3.47Å; Q172-L176 PolarHBondContact O-N 3.36Å
173	I	97.7	Very high	96.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-41.8	171.8	-65.5	-60	0	0	0	111	F168 T169 A170 Q175 L176 A177 I191 L197 S201 Y202 L205	F168-I173 HydrophobicContact CB-CD1 4.01Å; F168-I173 HydrophobicContact CB-CG1 4.3Å; F168-I173 HydrophobicContact CD2-CD1 3.68Å; F168-I173 HydrophobicContact CE2-CD1 4.42Å; F168-I173 HydrophobicContact CG-CD1 4.09Å; T169-I173 PolarHBondContact O-N 2.94Å; A170-I173 PolarHBondContact O-N 3.17Å; I173-Q175 VanDerWaalsContact C-N 3.33Å; I173-Q175 PolarHBondContact O-N 3.06Å; I173-L176 PolarHBondContact O-N 2.78Å; I173-A177 WeakPolarHBondContact O-CB 3.35Å; I173-A177 PolarHBondContact O-N 2.95Å; I173-I191 HydrophobicContact CD1-CD1 3.71Å; I173-L197 HydrophobicContact CD1-CD1 4.43Å; I173-L197 HydrophobicContact CG1-CD1 3.51Å; I173-S201 WeakPolarHBondContact CG2-O 3.46Å; I173-Y202 HydrophobicContact CD1-CD1 4.43Å; I173-Y202 HydrophobicContact CD1-CE1 4.16Å; I173-Y202 HydrophobicContact CG1-CE1 4.49Å; I173-L205 HydrophobicContact CG2-CD1 4.35Å; I173-L205 HydrophobicContact CG2-CD2 4.15Å; I173-L205 HydrophobicContact CG2-CG 4.06Å
174	T	97.4	Very high	96.1	Very high	60 Å²	60	47.6 Å²	47.6	37%	0.368	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176	-56.2	0	0	0	0	111	A170 E171 Q172 A177 S178 Q204	A170-T174 PolarHBondContact O-N 3.29Å; A170-T174 PolarHBondContact O-OG1 2.91Å; E171-T174 WeakPolarHBondContact O-CB 3.39Å; E171-T174 PolarHBondContact O-N 3.3Å; Q172-T174 VanDerWaalsContact C-N 3.35Å; T174-A177 PolarHBondContact O-N 2.94Å; T174-S178 PolarHBondContact O-N 3.2Å; T174-Q204 PolarHBondContact OG1-NE2 3.39Å; T174-Q204 VanDerWaalsContact OG1-NE2 3.09Å; T174-Q204 PolarHBondContact OG1-OE1 2.88Å
175	Q	97.7	Very high	96.1	Very high	47 Å²	47	43.7 Å²	43.7	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-44.9	176	-172	-175.4	-0.1	0	0	111.9	L145 D146 I149 E171 Q172 I173 S178 F179	L145-Q175 HydrophobicContact CD2-CB 4.42Å; D146-Q175 PolarHBondContact OD1-NE2 3.01Å; I149-Q175 HydrophobicContact CD1-CG 3.77Å; E171-Q175 WeakPolarHBondContact O-CB 3.48Å; E171-Q175 PolarHBondContact O-N 2.85Å; Q172-Q175 PolarHBondContact O-N 3.12Å; I173-Q175 VanDerWaalsContact C-N 3.33Å; I173-Q175 PolarHBondContact O-N 3.06Å; Q175-S178 PolarHBondContact O-N 3.38Å; Q175-F179 PolarHBondContact O-N 3.43Å
176	L	97.7	Very high	96.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-41.3	176.6	-176.9	63.2	0	0	0	111.4	L161 F163 F168 Q172 I173 F179 L180 L189 I191 L205	L161-L176 HydrophobicContact CD1-CD1 4.48Å; F163-L176 HydrophobicContact CE2-CD2 4.17Å; F168-L176 HydrophobicContact CE2-CD2 4.22Å; F168-L176 HydrophobicContact CZ-CD2 4.44Å; Q172-L176 WeakPolarHBondContact O-CB 3.47Å; Q172-L176 PolarHBondContact O-N 3.36Å; I173-L176 PolarHBondContact O-N 2.78Å; L176-F179 HydrophobicContact CD1-CD1 4.16Å; L176-F179 PolarHBondContact O-N 3.31Å; L176-L180 HydrophobicContact CG-CD1 4.09Å; L176-L180 WeakPolarHBondContact O-CG 3.49Å; L176-L180 PolarHBondContact O-N 3.1Å; L176-L189 HydrophobicContact CD2-CD1 4.22Å; L176-L189 HydrophobicContact CD2-CD2 4.17Å; L176-I191 HydrophobicContact CD2-CD1 3.98Å; L176-L205 HydrophobicContact CD2-CD2 4.34Å; L176-L205 HydrophobicContact CG-CD2 4.45Å
177	A	97.6	Very high	96.5	Very high	7 Å²	7	39.6 Å²	39.6	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-45.8	175.5	0	0	0	0	0	111.6	I173 T174 F179 L180 S181 Q204 L205	I173-A177 WeakPolarHBondContact O-CB 3.35Å; I173-A177 PolarHBondContact O-N 2.95Å; T174-A177 PolarHBondContact O-N 2.94Å; A177-F179 PolarHBondContact O-N 3.29Å; A177-L180 PolarHBondContact O-N 3.26Å; A177-L180 VanDerWaalsContact O-N 3.13Å; A177-S181 PolarHBondContact O-N 3.04Å; A177-S181 PolarHBondContact O-OG 3.45Å; A177-Q204 HydrophobicContact CB-CB 3.98Å; A177-L205 HydrophobicContact CB-CD2 4.32Å
178	S	97.4	Very high	96.8	Very high	78 Å²	78	39.9 Å²	39.9	55%	0.545	23%	0.229	S	C	.	.	H	α-helix	trans	-59	-44.4	175.3	-179.7	0	0	0	0	112.4	T174 Q175 L180 S181 T182	T174-S178 PolarHBondContact O-N 3.2Å; Q175-S178 PolarHBondContact O-N 3.38Å; S178-L180 PolarHBondContact O-N 3.32Å; S178-S181 WeakPolarHBondContact O-CB 3.34Å; S178-S181 PolarHBondContact O-N 3.46Å; S178-T182 PolarHBondContact O-N 3.06Å
179	F	97	Very high	96.9	Very high	10 Å²	10	39.8 Å²	39.8	4%	0.044	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-47.3	173	164.6	-109.5	0	0	0	111.6	I149 F152 S153 L161 Q175 L176 A177 S181 T182 N183 I186	I149-F179 HydrophobicContact CD1-CB 4.1Å; I149-F179 HydrophobicContact CG1-CB 4.28Å; I149-F179 HydrophobicContact CG1-CD1 4.5Å; I149-F179 HydrophobicContact CG1-CG 4.23Å; I149-F179 HydrophobicContact CG2-CB 4.09Å; I149-F179 HydrophobicContact CG2-CD2 3.67Å; I149-F179 HydrophobicContact CG2-CE2 4.35Å; I149-F179 HydrophobicContact CG2-CG 3.96Å; F152-F179 HydrophobicContact CB-CE1 4.11Å; F152-F179 HydrophobicContact CB-CE2 4.25Å; F152-F179 HydrophobicContact CB-CZ 3.56Å; F152-F179 HydrophobicContact CD2-CE1 4.32Å; S153-F179 WeakPolarHBondContact OG-CE2 3.4Å; L161-F179 HydrophobicContact CD1-CE1 4.45Å; Q175-F179 PolarHBondContact O-N 3.43Å; L176-F179 HydrophobicContact CD1-CD1 4.16Å; L176-F179 PolarHBondContact O-N 3.31Å; A177-F179 PolarHBondContact O-N 3.29Å; F179-S181 VanDerWaalsContact C-N 3.26Å; F179-S181 PolarHBondContact O-N 2.77Å; F179-T182 PolarHBondContact O-N 3.37Å; F179-T182 PolarHBondContact O-OG1 3.38Å; F179-N183 HydrophobicContact CD2-CB 4.43Å; F179-N183 HydrophobicContact CE1-CB 4.34Å; F179-N183 HydrophobicContact CE2-CB 3.96Å; F179-N183 HydrophobicContact CZ-CB 3.91Å; F179-N183 WeakPolarHBondContact O-CB 3.42Å; F179-N183 PolarHBondContact O-N 3.37Å; F179-I186 HydrophobicContact CE1-CG1 4.24Å
180	L	97.6	Very high	97	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-29.2	-179.4	-68.4	165.7	0	0	0	113.3	L176 A177 S178 T182 I186 L189 L205 N210 L212	L176-L180 HydrophobicContact CG-CD1 4.09Å; L176-L180 WeakPolarHBondContact O-CG 3.49Å; L176-L180 PolarHBondContact O-N 3.1Å; A177-L180 PolarHBondContact O-N 3.26Å; A177-L180 VanDerWaalsContact O-N 3.13Å; S178-L180 PolarHBondContact O-N 3.32Å; L180-T182 VanDerWaalsContact C-N 3.32Å; L180-I186 HydrophobicContact CD2-CB 3.85Å; L180-I186 HydrophobicContact CD2-CG1 4.24Å; L180-I186 HydrophobicContact CD2-CG2 3.61Å; L180-L189 HydrophobicContact CD1-CD2 3.89Å; L180-L205 HydrophobicContact CD1-CD2 4.01Å; L180-N210 HydrophobicContact CB-CB 4Å; L180-N210 WeakPolarHBondContact O-CB 3.24Å; L180-L212 HydrophobicContact CD1-CD1 4.14Å; L180-L212 HydrophobicContact CD2-CD2 4.36Å
181	S	96.3	Very high	97.1	Very high	44 Å²	44	35.9 Å²	35.9	31%	0.308	20%	0.202	S	C	.	.	H	α-helix	trans	-68.1	-29.6	173.5	-67.3	0	0	0	0	113.2	A177 S178 F179 S209	A177-S181 PolarHBondContact O-N 3.04Å; A177-S181 PolarHBondContact O-OG 3.45Å; S178-S181 WeakPolarHBondContact O-CB 3.34Å; S178-S181 PolarHBondContact O-N 3.46Å; F179-S181 VanDerWaalsContact C-N 3.26Å; F179-S181 PolarHBondContact O-N 2.77Å; S181-S209 WeakPolarHBondContact CB-OG 3.45Å; S181-S209 PolarHBondContact OG-OG 2.93Å
182	T	95.1	Very high	97.2	Very high	116 Å²	116	30.3 Å²	30.3	71%	0.712	18%	0.176	S	C	*	.	H	α-helix	trans	-92.2	-23.4	177.5	64.6	0	0	0	0	113.1	S178 F179 L180	S178-T182 PolarHBondContact O-N 3.06Å; F179-T182 PolarHBondContact O-N 3.37Å; F179-T182 PolarHBondContact O-OG1 3.38Å; L180-T182 VanDerWaalsContact C-N 3.32Å
183	N	94.8	Very high	97.1	Very high	16 Å²	16	31.5 Å²	31.5	9%	0.086	19%	0.186	C	C	.	.			trans	-85.9	137.9	-179.6	179.1	-78.3	0	0	0	112.2	F179 T185 I186 N211	F179-N183 HydrophobicContact CD2-CB 4.43Å; F179-N183 HydrophobicContact CE1-CB 4.34Å; F179-N183 HydrophobicContact CE2-CB 3.96Å; F179-N183 HydrophobicContact CZ-CB 3.91Å; F179-N183 WeakPolarHBondContact O-CB 3.42Å; F179-N183 PolarHBondContact O-N 3.37Å; N183-T185 PolarHBondContact ND2-OG1 2.86Å; N183-T185 VanDerWaalsContact ND2-OG1 3.13Å; N183-T185 PolarHBondContact OD1-N 2.84Å; N183-T185 PolarHBondContact OD1-OG1 2.8Å; N183-I186 WeakPolarHBondContact OD1-CB 3.45Å; N183-I186 VanDerWaalsContact OD1-CG1 3.26Å; N183-I186 WeakPolarHBondContact OD1-CG1 2.89Å; N183-I186 PolarHBondContact OD1-N 2.73Å; N183-N211 PolarHBondContact O-ND2 3.47Å
184	N	94	Very high	96.8	Very high	114 Å²	114	31.8 Å²	31.8	61%	0.61	19%	0.188	S	C	*	.	S	Bend	trans	-107.8	-9.1	179.3	63.2	5	0	0	0	114.8	K187	N184-K187 PolarHBondContact O-NZ 2.74Å
185	T	95.8	Very high	96.5	Very high	29 Å²	29	34.8 Å²	34.8	18%	0.178	20%	0.198	C	C	.	.	S	Bend	trans	-93.3	-36.7	-172.7	65.7	0	0	0	0	112.9	N156 L158 S159 N183 K187	N156-T185 WeakPolarHBondContact O-CG2 3.32Å; L158-T185 CarbonylContact O-C 3.44Å; L158-T185 WeakPolarHBondContact O-CB 3.44Å; L158-T185 PolarHBondContact O-OG1 2.71Å; S159-T185 WeakPolarHBondContact CA-O 3.06Å; N183-T185 PolarHBondContact ND2-OG1 2.86Å; N183-T185 VanDerWaalsContact ND2-OG1 3.13Å; N183-T185 PolarHBondContact OD1-N 2.84Å; N183-T185 PolarHBondContact OD1-OG1 2.8Å; T185-K187 PolarHBondContact O-N 3.45Å
186	I	97.9	Very high	96.3	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	21%	0.209	C	C	.	.			trans	-68.9	119.6	-178.4	-56.4	-60.4	0	0	0	110.1	L158 L161 F179 L180 N183 L212	L158-I186 HydrophobicContact CB-CD1 4.24Å; L158-I186 HydrophobicContact CD2-CD1 4.09Å; L158-I186 HydrophobicContact CG-CD1 3.62Å; L158-I186 WeakPolarHBondContact O-CD1 3.26Å; L161-I186 HydrophobicContact CD1-CD1 4.11Å; L161-I186 HydrophobicContact CD1-CG1 4.38Å; L161-I186 HydrophobicContact CD1-CG2 4.44Å; L161-I186 HydrophobicContact CG-CD1 3.97Å; F179-I186 HydrophobicContact CE1-CG1 4.24Å; L180-I186 HydrophobicContact CD2-CB 3.85Å; L180-I186 HydrophobicContact CD2-CG1 4.24Å; L180-I186 HydrophobicContact CD2-CG2 3.61Å; N183-I186 WeakPolarHBondContact OD1-CB 3.45Å; N183-I186 VanDerWaalsContact OD1-CG1 3.26Å; N183-I186 WeakPolarHBondContact OD1-CG1 2.89Å; N183-I186 PolarHBondContact OD1-N 2.73Å; I186-L212 HydrophobicContact CG2-CD2 3.86Å
187	K	97.8	Very high	96.2	Very high	78 Å²	78	36.6 Å²	36.6	34%	0.339	22%	0.217	S	C	.	.			trans	-115.7	-25.2	177	-55.6	-53.2	-174.2	-165.1	0	112.7	S159 N184 T185 N211 T213 K214	S159-K187 PolarHBondContact O-N 2.51Å; N184-K187 PolarHBondContact O-NZ 2.74Å; T185-K187 PolarHBondContact O-N 3.45Å; K187-N211 HydrophobicContact CD-CB 4.21Å; K187-N211 VanDerWaalsContact CD-O 3.23Å; K187-N211 WeakPolarHBondContact CD-O 3.18Å; K187-T213 PolarHBondContact O-N 3.44Å; K187-T213 PolarHBondContact O-OG1 3.15Å; K187-K214 PolarHBondContact O-N 2.7Å
188	S	98.6	Very high	96.1	Very high	19 Å²	19	43.4 Å²	43.4	13%	0.133	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.5	-175.1	179.5	0	0	0	0	111.2	S159 K160 L161 K214	S159-S188 PolarHBondContact O-N 3.26Å; K160-S188 CarbonylContact C-O 3.54Å; K160-S188 VanDerWaalsContact CA-O 3.3Å; K160-S188 WeakPolarHBondContact CA-O 3.26Å; L161-S188 PolarHBondContact N-O 2.99Å; S188-K214 WeakPolarHBondContact CA-O 3.44Å
189	L	98.6	Very high	96.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131	174.3	179.3	62.5	0	0	0	110.4	L161 F163 L176 L180 I191 L205 L212 K214 L215 R216	L161-L189 HydrophobicContact CB-CD1 3.83Å; F163-L189 HydrophobicContact CD2-CD1 3.91Å; F163-L189 HydrophobicContact CE2-CD1 3.87Å; L176-L189 HydrophobicContact CD2-CD1 4.22Å; L176-L189 HydrophobicContact CD2-CD2 4.17Å; L180-L189 HydrophobicContact CD1-CD2 3.89Å; L189-I191 HydrophobicContact CD1-CD1 4.4Å; L189-I191 HydrophobicContact CD1-CG1 4.09Å; L189-I191 HydrophobicContact CD2-CD1 4.07Å; L189-I191 HydrophobicContact CD2-CG1 4.44Å; L189-I191 HydrophobicContact CG-CD1 4.32Å; L189-I191 HydrophobicContact CG-CG1 4.14Å; L189-L205 HydrophobicContact CD2-CD1 4.01Å; L189-L205 HydrophobicContact CD2-CD2 3.89Å; L189-L205 HydrophobicContact CD2-CG 4.4Å; L189-L212 HydrophobicContact CB-CD1 4Å; L189-L212 HydrophobicContact CB-CD2 3.83Å; L189-L212 HydrophobicContact CD2-CD1 4.05Å; L189-K214 PolarHBondContact N-O 3.14Å; L189-L215 HydrophobicContact CB-CD1 4.12Å; L189-L215 HydrophobicContact CD2-CD1 4.04Å; L189-L215 HydrophobicContact CG-CD1 4.15Å; L189-L215 WeakPolarHBondContact O-CA 3.49Å; L189-R216 PolarHBondContact O-N 3.29Å
190	T	98.6	Very high	96	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.6	169.8	-66.2	0	0	0	0	108.9	L161 V162 F163 D192 R216	L161-T190 PolarHBondContact O-N 3.13Å; V162-T190 HydrophobicContact CG1-CG2 4.1Å; F163-T190 PolarHBondContact N-O 3.45Å; T190-D192 HydrophobicContact CG2-CB 4.29Å; T190-R216 WeakPolarHBondContact CA-O 3.35Å; T190-R216 HydrophobicContact CG2-CB 4.23Å; T190-R216 HydrophobicContact CG2-CG 4.25Å; T190-R216 PolarHBondContact OG1-NH1 2.82Å
191	I	98	Very high	96	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	99.4	170.1	-59.2	176.7	0	0	0	105.7	F163 F168 I173 L176 L189 N194 Y202 L205 R216 L217 C220	F163-I191 HydrophobicContact CB-CG1 4.37Å; F163-I191 HydrophobicContact CD2-CG1 4.1Å; F163-I191 CarbonylContact O-C 3.45Å; F163-I191 WeakPolarHBondContact O-CA 3.37Å; F168-I191 HydrophobicContact CD2-CD1 4.13Å; F168-I191 HydrophobicContact CD2-CG2 4.04Å; F168-I191 HydrophobicContact CE2-CD1 4.03Å; F168-I191 HydrophobicContact CE2-CG1 4.24Å; F168-I191 HydrophobicContact CE2-CG2 4.5Å; I173-I191 HydrophobicContact CD1-CD1 3.71Å; L176-I191 HydrophobicContact CD2-CD1 3.98Å; L189-I191 HydrophobicContact CD1-CD1 4.4Å; L189-I191 HydrophobicContact CD1-CG1 4.09Å; L189-I191 HydrophobicContact CD2-CD1 4.07Å; L189-I191 HydrophobicContact CD2-CG1 4.44Å; L189-I191 HydrophobicContact CG-CD1 4.32Å; L189-I191 HydrophobicContact CG-CG1 4.14Å; I191-N194 HydrophobicContact CG2-CB 4.36Å; I191-N194 WeakPolarHBondContact CG2-ND2 3.46Å; I191-Y202 HydrophobicContact CG2-CE1 4.22Å; I191-L205 HydrophobicContact CD1-CD1 3.73Å; I191-R216 PolarHBondContact N-O 2.82Å; I191-L217 HydrophobicContact CB-CD2 3.94Å; I191-L217 VanDerWaalsContact O-CA 3.29Å; I191-L217 WeakPolarHBondContact O-CA 3.44Å; I191-C220 PolarHBondContact O-SG 3.32Å
192	D	97.6	Very high	96.1	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.037	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	150.4	-175	-79.1	-3.4	0	0	0	111.1	F163 W164 R165 T190 N194 R216 R218	F163-D192 PolarHBondContact O-N 2.95Å; W164-D192 CarbonylContact C-O 3.4Å; W164-D192 WeakPolarHBondContact CA-O 3.47Å; R165-D192 PolarHBondContact N-O 3.03Å; T190-D192 HydrophobicContact CG2-CB 4.29Å; D192-N194 PolarHBondContact O-N 3.46Å; D192-N194 PolarHBondContact O-ND2 2.95Å; D192-R216 WeakPolarHBondContact OD1-CD 3.35Å; D192-R216 VanDerWaalsContact OD1-CG 3.26Å; D192-R216 WeakPolarHBondContact OD1-CG 3.4Å; D192-R216 WeakPolarHBondContact OD2-CD 3.38Å; D192-R218 CarbonylContact C-O 3.37Å; D192-R218 VanDerWaalsContact CA-O 3.25Å; D192-R218 WeakPolarHBondContact CA-O 3.21Å; D192-R218 WeakPolarHBondContact OD1-CB 3.36Å; D192-R218 PolarHBondContact OD1-N 2.97Å; D192-R218 IonicContact OD1-NE 3.2Å; D192-R218 IonicContact OD2-CZ 2.71Å; D192-R218 VanDerWaalsContact OD2-CZ 3.26Å; D192-R218 IonicContact OD2-NE 3.74Å; D192-R218 PolarHBondContact OD2-NE 3.37Å; D192-R218 IonicContact OD2-NH2 2.95Å; D192-R218 PolarHBondContact OD2-NH2 3.27Å
193	A	95.5	Very high	96.2	Very high	28 Å²	28	37.5 Å²	37.5	23%	0.231	21%	0.207	C	C	.	.	S	Bend	trans	56.6	45.1	173.3	0	0	0	0	0	113.3	R165 R218 Y219	R165-A193 WeakPolarHBondContact CA-O 3.44Å; R165-A193 HydrophobicContact CB-CB 4.26Å; R165-A193 WeakPolarHBondContact CB-O 3.3Å; A193-R218 PolarHBondContact N-O 3.35Å; A193-Y219 CarbonylContact C-O 3.52Å; A193-Y219 WeakPolarHBondContact CA-O 3.28Å; A193-Y219 PolarHBondContact N-O 3.13Å
194	N	92.4	Very high	96.4	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.037	22%	0.217	C	C	.	.			trans	-109.1	162	175.6	-71.6	-84.8	0	0	0	110.9	V166 G167 I191 D192 Y219 C220	V166-N194 WeakPolarHBondContact CG2-OD1 3.41Å; V166-N194 PolarHBondContact N-OD1 3.29Å; G167-N194 PolarHBondContact N-OD1 2.89Å; I191-N194 HydrophobicContact CG2-CB 4.36Å; I191-N194 WeakPolarHBondContact CG2-ND2 3.46Å; D192-N194 PolarHBondContact O-N 3.46Å; D192-N194 PolarHBondContact O-ND2 2.95Å; N194-Y219 PolarHBondContact N-O 2.76Å; N194-C220 CarbonylContact O-C 3.51Å; N194-C220 WeakPolarHBondContact O-CA 3.21Å
195	E	90	Very high	96.5	Very high	122 Å²	122	34.5 Å²	34.5	57%	0.57	19%	0.188	S	C	*	.			trans	-68.3	162.1	-177.7	-63.9	171.2	-170.1	0	0	111.6	Y202	E195-Y202 PolarHBondContact O-OH 2.97Å
196	A	93.4	Very high	96.6	Very high	56 Å²	56	33.2 Å²	33.2	46%	0.463	18%	0.18	S	C	.	.			trans	-58.3	140.3	169.3	0	0	0	0	0	111.1	E221	A196-E221 HydrophobicContact CB-CB 3.84Å; A196-E221 WeakPolarHBondContact CB-OE2 3.36Å; A196-E221 PolarHBondContact N-OE2 2.61Å
197	L	95.8	Very high	96.5	Very high	29 Å²	29	35 Å²	35	15%	0.152	19%	0.19	C	C	.	.			trans	-121.8	169.8	177.9	-65.2	-177.5	0	0	0	110.3	F168 I173 Y202	F168-L197 WeakPolarHBondContact O-CD2 3.44Å; I173-L197 HydrophobicContact CD1-CD1 4.43Å; I173-L197 HydrophobicContact CG1-CD1 3.51Å; L197-Y202 HydrophobicContact CB-CE2 4.35Å; L197-Y202 HydrophobicContact CD1-CE1 3.98Å; L197-Y202 HydrophobicContact CD1-CE2 4.05Å; L197-Y202 HydrophobicContact CG-CE2 4.25Å
198	E	96.2	Very high	96.2	Very high	151 Å²	151	37.3 Å²	37.3	71%	0.706	20%	0.202	S	C	*	.			trans	-56.4	143	172.3	-173.8	180	178	0	0	111.2	G200 S201	E198-G200 PolarHBondContact O-N 3.09Å; E198-S201 VanDerWaalsContact O-CB 3.24Å; E198-S201 WeakPolarHBondContact O-CB 3.44Å; E198-S201 PolarHBondContact O-N 3Å; E198-S201 PolarHBondContact O-OG 3.31Å
199	I	96.4	Very high	96	Very high	92 Å²	92	39 Å²	39	47%	0.472	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	129.3	177.2	-63.2	166.2	0	0	0	109.7	M225 E226 S229	I199-M225 HydrophobicContact CD1-CB 3.8Å; I199-M225 HydrophobicContact CD1-CG 4.4Å; I199-M225 HydrophobicContact CG1-CB 4.09Å; I199-M225 HydrophobicContact CG2-CB 4.31Å; I199-E226 WeakPolarHBondContact CG1-OE1 3.14Å; I199-S229 WeakPolarHBondContact CG2-OG 3.29Å
200	G	95.9	Very high	95.8	Very high	20 Å²	20	39 Å²	39	21%	0.206	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	-11.8	179.7	0	0	0	0	0	115.1	E198 Y202 A203 Q204	E198-G200 PolarHBondContact O-N 3.09Å; G200-Y202 PolarHBondContact O-N 3.3Å; G200-A203 WeakPolarHBondContact O-CB 3.39Å; G200-A203 PolarHBondContact O-N 2.87Å; G200-Q204 PolarHBondContact O-N 2.93Å
201	S	97.7	Very high	95.7	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.028	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-57.4	178.2	-61.3	0	0	0	0	111.8	A170 I173 E198 A203 Q204	A170-S201 WeakPolarHBondContact CB-OG 3.47Å; I173-S201 WeakPolarHBondContact CG2-O 3.46Å; E198-S201 VanDerWaalsContact O-CB 3.24Å; E198-S201 WeakPolarHBondContact O-CB 3.44Å; E198-S201 PolarHBondContact O-N 3Å; E198-S201 PolarHBondContact O-OG 3.31Å; S201-A203 PolarHBondContact O-N 2.83Å; S201-Q204 WeakPolarHBondContact O-CB 3.43Å; S201-Q204 WeakPolarHBondContact O-CG 3.36Å; S201-Q204 PolarHBondContact O-N 2.92Å
202	Y	97.9	Very high	95.7	Very high	7 Å²	7	41.1 Å²	41.1	3%	0.027	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-66.2	-25.7	178.4	-68.4	-60.8	0	0	0	113.5	I173 I191 E195 L197 G200 Q204 L205 L217 C220 I222	I173-Y202 HydrophobicContact CD1-CD1 4.43Å; I173-Y202 HydrophobicContact CD1-CE1 4.16Å; I173-Y202 HydrophobicContact CG1-CE1 4.49Å; I191-Y202 HydrophobicContact CG2-CE1 4.22Å; E195-Y202 PolarHBondContact O-OH 2.97Å; L197-Y202 HydrophobicContact CB-CE2 4.35Å; L197-Y202 HydrophobicContact CD1-CE1 3.98Å; L197-Y202 HydrophobicContact CD1-CE2 4.05Å; L197-Y202 HydrophobicContact CG-CE2 4.25Å; G200-Y202 PolarHBondContact O-N 3.3Å; Y202-Q204 PolarHBondContact O-N 3.34Å; Y202-L205 HydrophobicContact CD1-CD1 4.19Å; Y202-L205 WeakPolarHBondContact O-CB 3.35Å; Y202-L205 PolarHBondContact O-N 2.95Å; Y202-L205 VanDerWaalsContact O-N 3.16Å; Y202-L217 HydrophobicContact CD1-CD1 4.26Å; Y202-L217 HydrophobicContact CD1-CD2 3.75Å; Y202-L217 HydrophobicContact CE1-CD2 4.14Å; Y202-L217 HydrophobicContact CG-CD1 4.15Å; Y202-L217 HydrophobicContact CG-CD2 4.44Å; Y202-C220 HydrophobicContact CE2-CB 3.88Å; Y202-I222 HydrophobicContact CD2-CD1 4.08Å; Y202-I222 HydrophobicContact CD2-CG1 3.96Å; Y202-I222 HydrophobicContact CE2-CG1 4.17Å
203	A	97.8	Very high	95.7	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.033	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-66.8	-26	177.8	0	0	0	0	0	112	G200 S201 L205 I206 I230 R233	G200-A203 WeakPolarHBondContact O-CB 3.39Å; G200-A203 PolarHBondContact O-N 2.87Å; S201-A203 PolarHBondContact O-N 2.83Å; A203-L205 PolarHBondContact O-N 2.77Å; A203-I206 PolarHBondContact O-N 2.87Å; A203-I230 HydrophobicContact CB-CG1 4.34Å; A203-R233 HydrophobicContact CB-CG 3.98Å
204	Q	97.6	Very high	95.9	Very high	66 Å²	66	46.5 Å²	46.5	31%	0.308	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-61.2	-23.7	173.9	-58.5	-174.9	50	0	0	113.1	T174 A177 G200 S201 Y202 I206	T174-Q204 PolarHBondContact OG1-NE2 3.39Å; T174-Q204 VanDerWaalsContact OG1-NE2 3.09Å; T174-Q204 PolarHBondContact OG1-OE1 2.88Å; A177-Q204 HydrophobicContact CB-CB 3.98Å; G200-Q204 PolarHBondContact O-N 2.93Å; S201-Q204 WeakPolarHBondContact O-CB 3.43Å; S201-Q204 WeakPolarHBondContact O-CG 3.36Å; S201-Q204 PolarHBondContact O-N 2.92Å; Y202-Q204 PolarHBondContact O-N 3.34Å; Q204-I206 PolarHBondContact O-N 3.44Å
205	L	97.8	Very high	96.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-72.1	-15.2	175.5	-58.4	171.7	0	0	0	112.2	I173 L176 A177 L180 L189 I191 Y202 A203 N210 L215 L217	I173-L205 HydrophobicContact CG2-CD1 4.35Å; I173-L205 HydrophobicContact CG2-CD2 4.15Å; I173-L205 HydrophobicContact CG2-CG 4.06Å; L176-L205 HydrophobicContact CD2-CD2 4.34Å; L176-L205 HydrophobicContact CG-CD2 4.45Å; A177-L205 HydrophobicContact CB-CD2 4.32Å; L180-L205 HydrophobicContact CD1-CD2 4.01Å; L189-L205 HydrophobicContact CD2-CD1 4.01Å; L189-L205 HydrophobicContact CD2-CD2 3.89Å; L189-L205 HydrophobicContact CD2-CG 4.4Å; I191-L205 HydrophobicContact CD1-CD1 3.73Å; Y202-L205 HydrophobicContact CD1-CD1 4.19Å; Y202-L205 WeakPolarHBondContact O-CB 3.35Å; Y202-L205 PolarHBondContact O-N 2.95Å; Y202-L205 VanDerWaalsContact O-N 3.16Å; A203-L205 PolarHBondContact O-N 2.77Å; L205-N210 PolarHBondContact O-ND2 2.81Å; L205-L215 HydrophobicContact CB-CD2 4.33Å; L205-L215 HydrophobicContact CD1-CD1 4.35Å; L205-L217 HydrophobicContact CD1-CD2 4.16Å
206	I	97.6	Very high	96.6	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.231	C	C	.	.	S	Bend	trans	-105.3	66	178.8	-50.7	175.6	0	0	0	108.2	A203 Q204 L215 I230 R233 L234 N241 L244	A203-I206 PolarHBondContact O-N 2.87Å; Q204-I206 PolarHBondContact O-N 3.44Å; I206-L215 HydrophobicContact CD1-CD2 3.89Å; I206-L215 HydrophobicContact CG1-CD2 3.56Å; I206-I230 HydrophobicContact CD1-CB 4.46Å; I206-I230 HydrophobicContact CD1-CG1 4.49Å; I206-I230 HydrophobicContact CD1-CG2 3.76Å; I206-R233 HydrophobicContact CB-CB 3.79Å; I206-R233 HydrophobicContact CG2-CB 3.8Å; I206-R233 WeakPolarHBondContact O-CB 3.36Å; I206-L234 HydrophobicContact CD1-CD2 4.25Å; I206-L234 HydrophobicContact CG2-CD2 4.31Å; I206-N241 HydrophobicContact CG2-CB 4.35Å; I206-N241 VanDerWaalsContact CG2-ND2 3.35Å; I206-N241 WeakPolarHBondContact CG2-ND2 3.46Å; I206-L244 HydrophobicContact CD1-CD2 4.32Å; I206-L244 HydrophobicContact CG1-CD2 4.5Å; I206-L244 HydrophobicContact CG2-CD2 4.47Å
207	D	94.4	Very high	96.8	Very high	39 Å²	39	41.4 Å²	41.4	21%	0.209	21%	0.209	C	C	.	.			trans	-101.4	152.4	179	-168	-97.3	0	0	0	111.6	S209 N210	D207-S209 VanDerWaalsContact C-N 3.29Å; D207-S209 PolarHBondContact O-N 2.98Å; D207-S209 VanDerWaalsContact OD1-CB 3.26Å; D207-S209 WeakPolarHBondContact OD1-CB 3.23Å; D207-S209 PolarHBondContact OD1-N 3.28Å; D207-S209 PolarHBondContact OD1-OG 3.44Å; D207-N210 PolarHBondContact N-ND2 2.91Å
208	E	92.9	Very high	97	Very high	128 Å²	128	44.1 Å²	44.1	60%	0.598	22%	0.217	S	C	*	.	S	Bend	trans	-67	-31.3	179.4	63.3	-179.3	179	0	0	113.2	Y239 K243	E208-Y239 HydrophobicContact CB-CE2 3.91Å; E208-Y239 WeakPolarHBondContact CB-OH 3.34Å; E208-K243 PolarHBondContact O-NZ 2.88Å
209	S	94	Very high	97	Very high	53 Å²	53	42.5 Å²	42.5	37%	0.371	21%	0.205	S	C	.	.	S	Bend	trans	-74.2	-32.9	-176.2	63	0	0	0	0	112.2	S181 D207	S181-S209 WeakPolarHBondContact CB-OG 3.45Å; S181-S209 PolarHBondContact OG-OG 2.93Å; D207-S209 VanDerWaalsContact C-N 3.29Å; D207-S209 PolarHBondContact O-N 2.98Å; D207-S209 VanDerWaalsContact OD1-CB 3.26Å; D207-S209 WeakPolarHBondContact OD1-CB 3.23Å; D207-S209 PolarHBondContact OD1-N 3.28Å; D207-S209 PolarHBondContact OD1-OG 3.44Å
210	N	94.3	Very high	97.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.183	C	C	.	.	S	Bend	trans	-76.8	169.5	-176.9	81.2	46.5	0	0	0	112.7	L180 L205 D207 L212 K243	L180-N210 HydrophobicContact CB-CB 4Å; L180-N210 WeakPolarHBondContact O-CB 3.24Å; L205-N210 PolarHBondContact O-ND2 2.81Å; D207-N210 PolarHBondContact N-ND2 2.91Å; N210-L212 PolarHBondContact OD1-N 3.36Å; N210-L212 VanDerWaalsContact OD1-N 3.13Å; N210-K243 WeakPolarHBondContact O-CD 3.23Å; N210-K243 WeakPolarHBondContact O-CE 3.25Å; N210-K243 PolarHBondContact O-NZ 3.1Å
211	N	95.9	Very high	97.1	Very high	43 Å²	43	42.3 Å²	42.3	23%	0.23	20%	0.197	C	C	.	.			trans	-112.6	18.9	-172.7	-70.3	-71.5	0	0	0	114.3	N183 K187 T213	N183-N211 PolarHBondContact O-ND2 3.47Å; K187-N211 HydrophobicContact CD-CB 4.21Å; K187-N211 VanDerWaalsContact CD-O 3.23Å; K187-N211 WeakPolarHBondContact CD-O 3.18Å; N211-T213 PolarHBondContact O-N 2.87Å
212	L	98.2	Very high	97.1	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	20%	0.196	C	C	.	.			trans	-66	127.7	-178.2	-70.7	-176	0	0	0	111.4	L180 I186 L189 N210 K243 L244	L180-L212 HydrophobicContact CD1-CD1 4.14Å; L180-L212 HydrophobicContact CD2-CD2 4.36Å; I186-L212 HydrophobicContact CG2-CD2 3.86Å; L189-L212 HydrophobicContact CB-CD1 4Å; L189-L212 HydrophobicContact CB-CD2 3.83Å; L189-L212 HydrophobicContact CD2-CD1 4.05Å; N210-L212 PolarHBondContact OD1-N 3.36Å; N210-L212 VanDerWaalsContact OD1-N 3.13Å; L212-K243 CarbonylContact O-C 3.59Å; L212-L244 HydrophobicContact CB-CD1 4.5Å
213	T	98.4	Very high	97.1	Very high	37 Å²	37	42.3 Å²	42.3	23%	0.227	20%	0.199	C	C	.	.	S	Bend	trans	-108.7	-21.3	171.8	64.4	0	0	0	0	112	K187 N211 K243 I245 N246	K187-T213 PolarHBondContact O-N 3.44Å; K187-T213 PolarHBondContact O-OG1 3.15Å; N211-T213 PolarHBondContact O-N 2.87Å; T213-K243 WeakPolarHBondContact CA-O 3.45Å; T213-I245 PolarHBondContact O-N 3.49Å; T213-N246 PolarHBondContact O-N 3.1Å
214	K	98.8	Very high	97.2	Very high	111 Å²	111	44 Å²	44	48%	0.483	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.9	177.6	-51.4	-176	-179.4	176.5	0	110.1	K187 S188 L189 N246	K187-K214 PolarHBondContact O-N 2.7Å; S188-K214 WeakPolarHBondContact CA-O 3.44Å; L189-K214 PolarHBondContact N-O 3.14Å; K214-N246 WeakPolarHBondContact CA-O 3.43Å; K214-N246 HydrophobicContact CB-CB 4.22Å; K214-N246 HydrophobicContact CG-CB 4.01Å
215	L	98.8	Very high	97.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.9	175.4	-179.7	60.3	0	0	0	109.9	L189 L205 I206 L217 L244 N246 L247 D248	L189-L215 HydrophobicContact CB-CD1 4.12Å; L189-L215 HydrophobicContact CD2-CD1 4.04Å; L189-L215 HydrophobicContact CG-CD1 4.15Å; L189-L215 WeakPolarHBondContact O-CA 3.49Å; L205-L215 HydrophobicContact CB-CD2 4.33Å; L205-L215 HydrophobicContact CD1-CD1 4.35Å; I206-L215 HydrophobicContact CD1-CD2 3.89Å; I206-L215 HydrophobicContact CG1-CD2 3.56Å; L215-L217 HydrophobicContact CD1-CD2 4.03Å; L215-L217 HydrophobicContact CD1-CG 4.14Å; L215-L217 HydrophobicContact CD2-CD1 4.07Å; L215-L217 HydrophobicContact CD2-CG 4.37Å; L215-L217 HydrophobicContact CG-CD1 4.3Å; L215-L217 HydrophobicContact CG-CD2 4.49Å; L215-L217 HydrophobicContact CG-CG 4.05Å; L215-L244 HydrophobicContact CB-CD1 3.75Å; L215-L244 HydrophobicContact CB-CD2 4.46Å; L215-N246 PolarHBondContact N-O 2.97Å; L215-L247 HydrophobicContact CB-CD1 4.22Å; L215-L247 HydrophobicContact CD2-CD1 4.23Å; L215-L247 HydrophobicContact CG-CD1 4.25Å; L215-L247 WeakPolarHBondContact O-CA 3.43Å; L215-D248 PolarHBondContact O-N 2.84Å
216	R	98.8	Very high	97.2	Very high	78 Å²	78	46.3 Å²	46.3	29%	0.294	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.1	174.5	-179.5	-170.3	-72.4	122.1	-0.3	110	L189 T190 I191 D192 R218 D248	L189-R216 PolarHBondContact O-N 3.29Å; T190-R216 WeakPolarHBondContact CA-O 3.35Å; T190-R216 HydrophobicContact CG2-CB 4.23Å; T190-R216 HydrophobicContact CG2-CG 4.25Å; T190-R216 PolarHBondContact OG1-NH1 2.82Å; I191-R216 PolarHBondContact N-O 2.82Å; D192-R216 WeakPolarHBondContact OD1-CD 3.35Å; D192-R216 VanDerWaalsContact OD1-CG 3.26Å; D192-R216 WeakPolarHBondContact OD1-CG 3.4Å; D192-R216 WeakPolarHBondContact OD2-CD 3.38Å; R216-R218 HydrophobicContact CG-CG 3.74Å; R216-D248 WeakPolarHBondContact CA-O 3.48Å; R216-D248 HydrophobicContact CB-CB 4.15Å; R216-D248 HydrophobicContact CG-CB 3.88Å; R216-D248 IonicContact NE-OD2 3.26Å; R216-D248 PolarHBondContact NE-OD2 2.99Å; R216-D248 VanDerWaalsContact NE-OD2 3.12Å
217	L	98.5	Very high	97.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.221	C	C	.	.			trans	-132.3	56.4	-178.7	-59.2	174.4	0	0	0	110.7	I191 Y202 L205 L215 I222 I230 D248 L249 N252	I191-L217 HydrophobicContact CB-CD2 3.94Å; I191-L217 VanDerWaalsContact O-CA 3.29Å; I191-L217 WeakPolarHBondContact O-CA 3.44Å; Y202-L217 HydrophobicContact CD1-CD1 4.26Å; Y202-L217 HydrophobicContact CD1-CD2 3.75Å; Y202-L217 HydrophobicContact CE1-CD2 4.14Å; Y202-L217 HydrophobicContact CG-CD1 4.15Å; Y202-L217 HydrophobicContact CG-CD2 4.44Å; L205-L217 HydrophobicContact CD1-CD2 4.16Å; L215-L217 HydrophobicContact CD1-CD2 4.03Å; L215-L217 HydrophobicContact CD1-CG 4.14Å; L215-L217 HydrophobicContact CD2-CD1 4.07Å; L215-L217 HydrophobicContact CD2-CG 4.37Å; L215-L217 HydrophobicContact CG-CD1 4.3Å; L215-L217 HydrophobicContact CG-CD2 4.49Å; L215-L217 HydrophobicContact CG-CG 4.05Å; L217-I222 HydrophobicContact CB-CD1 3.75Å; L217-I222 HydrophobicContact CD1-CD1 3.99Å; L217-I230 HydrophobicContact CD1-CD1 4.18Å; L217-D248 PolarHBondContact N-O 3.3Å; L217-L249 HydrophobicContact CB-CD2 4Å; L217-L249 HydrophobicContact CD1-CD2 4.13Å; L217-N252 PolarHBondContact O-ND2 2.84Å
218	R	98.4	Very high	97.5	Very high	86 Å²	86	47.6 Å²	47.6	33%	0.325	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	143.2	-174.7	-62.4	-176.3	-60.6	-169.5	-3.3	111.8	D192 A193 R216 C220 D248 S250	D192-R218 CarbonylContact C-O 3.37Å; D192-R218 VanDerWaalsContact CA-O 3.25Å; D192-R218 WeakPolarHBondContact CA-O 3.21Å; D192-R218 WeakPolarHBondContact OD1-CB 3.36Å; D192-R218 PolarHBondContact OD1-N 2.97Å; D192-R218 IonicContact OD1-NE 3.2Å; D192-R218 IonicContact OD2-CZ 2.71Å; D192-R218 VanDerWaalsContact OD2-CZ 3.26Å; D192-R218 IonicContact OD2-NE 3.74Å; D192-R218 PolarHBondContact OD2-NE 3.37Å; D192-R218 IonicContact OD2-NH2 2.95Å; D192-R218 PolarHBondContact OD2-NH2 3.27Å; A193-R218 PolarHBondContact N-O 3.35Å; R216-R218 HydrophobicContact CG-CG 3.74Å; R218-C220 PolarHBondContact O-N 2.89Å; R218-D248 WeakPolarHBondContact CD-OD2 3.33Å; R218-S250 WeakPolarHBondContact CA-O 3.35Å; R218-S250 WeakPolarHBondContact CB-O 3.45Å; R218-S250 WeakPolarHBondContact CG-O 3.38Å
219	Y	97.7	Very high	97.7	Very high	117 Å²	117	42.4 Å²	42.4	46%	0.459	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	43.8	177.3	-53	-80.6	0	0	0	112	A193 N194 S250 G251	A193-Y219 CarbonylContact C-O 3.52Å; A193-Y219 WeakPolarHBondContact CA-O 3.28Å; A193-Y219 PolarHBondContact N-O 3.13Å; N194-Y219 PolarHBondContact N-O 2.76Å; Y219-S250 PolarHBondContact N-O 2.71Å; Y219-G251 VanDerWaalsContact CA-O 3.3Å; Y219-G251 WeakPolarHBondContact CA-O 3.37Å; Y219-G251 WeakPolarHBondContact CD1-O 3.5Å
220	C	97.3	Very high	97.9	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	19%	0.186	C	C	.	.	S	Bend	trans	-103	15.7	179.4	-83.1	0	0	0	0	112.4	I191 N194 Y202 R218 I222 N252	I191-C220 PolarHBondContact O-SG 3.32Å; N194-C220 CarbonylContact O-C 3.51Å; N194-C220 WeakPolarHBondContact O-CA 3.21Å; Y202-C220 HydrophobicContact CE2-CB 3.88Å; R218-C220 PolarHBondContact O-N 2.89Å; C220-I222 HydrophobicContact CB-CD1 3.98Å; C220-I222 HydrophobicContact CB-CG1 3.88Å; C220-I222 PolarHBondContact O-N 3.43Å; C220-I222 VanDerWaalsContact O-N 3.13Å; C220-N252 WeakPolarHBondContact CA-OD1 3.36Å; C220-N252 PolarHBondContact N-OD1 3.45Å
221	E	96.6	Very high	98.1	Very high	106 Å²	106	40 Å²	40	50%	0.495	19%	0.187	S	C	.	.			trans	52.7	32	-176.5	-61.1	-176.6	-171.4	0	0	114	A196 G223 N252	A196-E221 HydrophobicContact CB-CB 3.84Å; A196-E221 WeakPolarHBondContact CB-OE2 3.36Å; A196-E221 PolarHBondContact N-OE2 2.61Å; E221-G223 PolarHBondContact O-N 3.3Å; E221-N252 PolarHBondContact N-OD1 3.12Å
222	I	98.1	Very high	98.2	Very high	1 Å²	1	43 Å²	43	1%	0.005	20%	0.199	C	C	.	.			trans	-70	118.1	179.7	-63.4	174	0	0	0	109.6	Y202 L217 C220 E226 I230 L249 N252 Q253 L254	Y202-I222 HydrophobicContact CD2-CD1 4.08Å; Y202-I222 HydrophobicContact CD2-CG1 3.96Å; Y202-I222 HydrophobicContact CE2-CG1 4.17Å; L217-I222 HydrophobicContact CB-CD1 3.75Å; L217-I222 HydrophobicContact CD1-CD1 3.99Å; C220-I222 HydrophobicContact CB-CD1 3.98Å; C220-I222 HydrophobicContact CB-CG1 3.88Å; C220-I222 PolarHBondContact O-N 3.43Å; C220-I222 VanDerWaalsContact O-N 3.13Å; I222-E226 HydrophobicContact CB-CB 4.38Å; I222-E226 HydrophobicContact CG2-CB 3.63Å; I222-I230 HydrophobicContact CD1-CD1 4.08Å; I222-I230 HydrophobicContact CG2-CD1 4.24Å; I222-L249 HydrophobicContact CD1-CD2 4.1Å; I222-N252 HydrophobicContact CB-CB 3.9Å; I222-N252 PolarHBondContact N-OD1 2.9Å; I222-N252 WeakPolarHBondContact O-CB 3.37Å; I222-Q253 CarbonylContact O-C 3.19Å; I222-Q253 WeakPolarHBondContact O-CA 3.06Å; I222-Q253 PolarHBondContact O-N 2.86Å; I222-L254 HydrophobicContact CG2-CD2 3.8Å
223	G	98.2	Very high	98.2	Very high	10 Å²	10	47.8 Å²	47.8	10%	0.103	22%	0.217	C	C	.	.			trans	-95.5	-171.6	174.7	0	0	0	0	0	113.4	E221 M225 E226 A227	E221-G223 PolarHBondContact O-N 3.3Å; G223-M225 VanDerWaalsContact C-N 3.31Å; G223-M225 PolarHBondContact O-N 2.92Å; G223-E226 VanDerWaalsContact C-OE2 3.31Å; G223-E226 WeakPolarHBondContact CA-OE2 3.32Å; G223-E226 PolarHBondContact N-OE2 3.24Å; G223-E226 PolarHBondContact O-N 3.29Å; G223-A227 WeakPolarHBondContact O-CB 3.18Å; G223-A227 PolarHBondContact O-N 2.81Å
224	P	98.4	Very high	98.2	Very high	39 Å²	39	46.2 Å²	46.2	25%	0.253	21%	0.207	S	C	.	.	H	α-helix	trans	-59.4	-35.7	-179.4	-22.8	31	0	0	0	114.2	A227 K228 L254 E257	P224-A227 WeakPolarHBondContact O-CB 3.35Å; P224-A227 PolarHBondContact O-N 2.98Å; P224-K228 PolarHBondContact O-N 3.36Å; P224-L254 WeakPolarHBondContact CG-O 3.47Å; P224-E257 HydrophobicContact CB-CB 4.08Å; P224-E257 HydrophobicContact CB-CG 4.2Å
225	M	98.4	Very high	98	Very high	78 Å²	78	41.2 Å²	41.2	38%	0.384	19%	0.187	S	C	.	.	H	α-helix	trans	-78.1	-36	-176.3	-64.9	-55.4	-64.3	0	0	112.6	I199 G223 A227 K228 S229	I199-M225 HydrophobicContact CD1-CB 3.8Å; I199-M225 HydrophobicContact CD1-CG 4.4Å; I199-M225 HydrophobicContact CG1-CB 4.09Å; I199-M225 HydrophobicContact CG2-CB 4.31Å; G223-M225 VanDerWaalsContact C-N 3.31Å; G223-M225 PolarHBondContact O-N 2.92Å; M225-A227 VanDerWaalsContact C-N 3.34Å; M225-K228 HydrophobicContact CE-CD 4.2Å; M225-K228 WeakPolarHBondContact O-CB 3.23Å; M225-K228 PolarHBondContact O-N 3.21Å; M225-S229 PolarHBondContact O-N 3.33Å; M225-S229 VanDerWaalsContact O-N 3.13Å; M225-S229 PolarHBondContact O-OG 3.2Å; M225-S229 VanDerWaalsContact O-OG 3.07Å
226	E	98.1	Very high	97.8	Very high	38 Å²	38	43.5 Å²	43.5	18%	0.178	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-41	169.7	-63.2	73.6	-158.9	0	0	110.2	I199 I222 G223 K228 S229 I230	I199-E226 WeakPolarHBondContact CG1-OE1 3.14Å; I222-E226 HydrophobicContact CB-CB 4.38Å; I222-E226 HydrophobicContact CG2-CB 3.63Å; G223-E226 VanDerWaalsContact C-OE2 3.31Å; G223-E226 WeakPolarHBondContact CA-OE2 3.32Å; G223-E226 PolarHBondContact N-OE2 3.24Å; G223-E226 PolarHBondContact O-N 3.29Å; E226-K228 VanDerWaalsContact C-N 3.33Å; E226-K228 PolarHBondContact O-N 2.88Å; E226-S229 WeakPolarHBondContact O-CB 3.46Å; E226-S229 PolarHBondContact O-N 2.83Å; E226-I230 WeakPolarHBondContact O-CG1 3.22Å; E226-I230 PolarHBondContact O-N 3.49Å
227	A	98.5	Very high	97.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-42.4	173.7	0	0	0	0	0	112.2	G223 P224 M225 S229 I230 S231 L254	G223-A227 WeakPolarHBondContact O-CB 3.18Å; G223-A227 PolarHBondContact O-N 2.81Å; P224-A227 WeakPolarHBondContact O-CB 3.35Å; P224-A227 PolarHBondContact O-N 2.98Å; M225-A227 VanDerWaalsContact C-N 3.34Å; A227-S229 VanDerWaalsContact C-N 3.33Å; A227-S229 PolarHBondContact O-N 2.97Å; A227-I230 PolarHBondContact O-N 3.41Å; A227-S231 VanDerWaalsContact O-CB 3.29Å; A227-S231 WeakPolarHBondContact O-CB 3.49Å; A227-S231 PolarHBondContact O-N 2.86Å; A227-S231 PolarHBondContact O-OG 3.28Å; A227-L254 HydrophobicContact CB-CD2 3.41Å; A227-L254 VanDerWaalsContact CB-CD2 3.41Å
228	K	98.6	Very high	97	Very high	68 Å²	68	50.2 Å²	50.2	30%	0.296	24%	0.236	S	C	.	.	H	α-helix	trans	-56.5	-47.6	173.1	-172.6	178.8	-174.5	164	0	111.7	P224 M225 E226 S231 Q232 Y261	P224-K228 PolarHBondContact O-N 3.36Å; M225-K228 HydrophobicContact CE-CD 4.2Å; M225-K228 WeakPolarHBondContact O-CB 3.23Å; M225-K228 PolarHBondContact O-N 3.21Å; E226-K228 VanDerWaalsContact C-N 3.33Å; E226-K228 PolarHBondContact O-N 2.88Å; K228-S231 WeakPolarHBondContact O-CB 3.41Å; K228-S231 PolarHBondContact O-N 3.16Å; K228-Q232 WeakPolarHBondContact O-CG 3.37Å; K228-Q232 PolarHBondContact O-N 2.81Å; K228-Y261 HydrophobicContact CB-CD1 4.33Å; K228-Y261 HydrophobicContact CB-CD2 3.5Å; K228-Y261 VanDerWaalsContact CB-CD2 3.5Å; K228-Y261 HydrophobicContact CB-CE2 3.73Å; K228-Y261 HydrophobicContact CB-CG 3.84Å; K228-Y261 HydrophobicContact CD-CD1 4.35Å; K228-Y261 HydrophobicContact CD-CD2 4.45Å; K228-Y261 HydrophobicContact CD-CE1 3.87Å; K228-Y261 HydrophobicContact CD-CE2 3.99Å; K228-Y261 HydrophobicContact CG-CD1 3.91Å; K228-Y261 HydrophobicContact CG-CD2 3.98Å; K228-Y261 HydrophobicContact CG-CE1 3.95Å; K228-Y261 HydrophobicContact CG-CE2 4.04Å; K228-Y261 HydrophobicContact CG-CG 3.93Å
229	S	98.4	Very high	96.7	Very high	18 Å²	18	49 Å²	49	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-64.4	-42.4	-179.9	-56.3	0	0	0	0	111.8	I199 M225 E226 A227 S231 R233	I199-S229 WeakPolarHBondContact CG2-OG 3.29Å; M225-S229 PolarHBondContact O-N 3.33Å; M225-S229 VanDerWaalsContact O-N 3.13Å; M225-S229 PolarHBondContact O-OG 3.2Å; M225-S229 VanDerWaalsContact O-OG 3.07Å; E226-S229 WeakPolarHBondContact O-CB 3.46Å; E226-S229 PolarHBondContact O-N 2.83Å; A227-S229 VanDerWaalsContact C-N 3.33Å; A227-S229 PolarHBondContact O-N 2.97Å; S229-S231 VanDerWaalsContact C-N 3.34Å; S229-R233 WeakPolarHBondContact O-CG 3.46Å; S229-R233 PolarHBondContact O-N 3.2Å
230	I	98.6	Very high	96.6	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-45.8	172.5	-73.3	168.7	0	0	0	110.3	A203 I206 L217 I222 E226 A227 Q232 R233 L234 L247 L249	A203-I230 HydrophobicContact CB-CG1 4.34Å; I206-I230 HydrophobicContact CD1-CB 4.46Å; I206-I230 HydrophobicContact CD1-CG1 4.49Å; I206-I230 HydrophobicContact CD1-CG2 3.76Å; L217-I230 HydrophobicContact CD1-CD1 4.18Å; I222-I230 HydrophobicContact CD1-CD1 4.08Å; I222-I230 HydrophobicContact CG2-CD1 4.24Å; E226-I230 WeakPolarHBondContact O-CG1 3.22Å; E226-I230 PolarHBondContact O-N 3.49Å; A227-I230 PolarHBondContact O-N 3.41Å; I230-Q232 PolarHBondContact O-N 2.82Å; I230-R233 CarbonylContact O-C 3.5Å; I230-R233 WeakPolarHBondContact O-CA 3.4Å; I230-R233 WeakPolarHBondContact O-CB 3.43Å; I230-R233 PolarHBondContact O-N 2.88Å; I230-L234 HydrophobicContact CG2-CD1 4.12Å; I230-L234 HydrophobicContact CG2-CG 4.39Å; I230-L234 WeakPolarHBondContact O-CG 3.34Å; I230-L234 PolarHBondContact O-N 3Å; I230-L247 HydrophobicContact CG2-CD2 4.18Å; I230-L249 HydrophobicContact CD1-CD2 4.16Å
231	S	98.4	Very high	96.5	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-44.5	-178.7	-58.8	0	0	0	0	112.1	A227 K228 S229 R233 L234 G235 Y261 L262 A265	A227-S231 VanDerWaalsContact O-CB 3.29Å; A227-S231 WeakPolarHBondContact O-CB 3.49Å; A227-S231 PolarHBondContact O-N 2.86Å; A227-S231 PolarHBondContact O-OG 3.28Å; K228-S231 WeakPolarHBondContact O-CB 3.41Å; K228-S231 PolarHBondContact O-N 3.16Å; S229-S231 VanDerWaalsContact C-N 3.34Å; S231-R233 PolarHBondContact O-N 3.15Å; S231-L234 WeakPolarHBondContact O-CB 3.34Å; S231-L234 PolarHBondContact O-N 2.91Å; S231-G235 PolarHBondContact O-N 2.87Å; S231-Y261 VanDerWaalsContact CB-O 3.27Å; S231-Y261 WeakPolarHBondContact CB-O 3.28Å; S231-Y261 PolarHBondContact OG-O 2.91Å; S231-L262 WeakPolarHBondContact OG-CA 3.1Å; S231-L262 WeakPolarHBondContact OG-CD2 3.45Å; S231-L262 PolarHBondContact OG-N 2.88Å; S231-A265 VanDerWaalsContact O-CB 3.23Å; S231-A265 WeakPolarHBondContact O-CB 3.25Å
232	Q	97.7	Very high	96.4	Very high	105 Å²	105	46.6 Å²	46.6	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-31	174.6	-72.5	174	-24.2	0	0	112.9	K228 I230 T236	K228-Q232 WeakPolarHBondContact O-CG 3.37Å; K228-Q232 PolarHBondContact O-N 2.81Å; I230-Q232 PolarHBondContact O-N 2.82Å; Q232-T236 HydrophobicContact CB-CG2 4.5Å
233	R	97.7	Very high	96.4	Very high	105 Å²	105	49.7 Å²	49.7	40%	0.396	24%	0.238	S	C	.	.	H	α-helix	trans	-82.4	-21.4	175	-66.5	-65.9	-176.4	176	2.2	113.6	A203 I206 S229 I230 S231 Y239 N241	A203-R233 HydrophobicContact CB-CG 3.98Å; I206-R233 HydrophobicContact CB-CB 3.79Å; I206-R233 HydrophobicContact CG2-CB 3.8Å; I206-R233 WeakPolarHBondContact O-CB 3.36Å; S229-R233 WeakPolarHBondContact O-CG 3.46Å; S229-R233 PolarHBondContact O-N 3.2Å; I230-R233 CarbonylContact O-C 3.5Å; I230-R233 WeakPolarHBondContact O-CA 3.4Å; I230-R233 WeakPolarHBondContact O-CB 3.43Å; I230-R233 PolarHBondContact O-N 2.88Å; S231-R233 PolarHBondContact O-N 3.15Å; R233-Y239 WeakPolarHBondContact O-CE1 3.37Å; R233-N241 WeakPolarHBondContact O-CB 3.25Å
234	L	97.7	Very high	96.4	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-76.7	-47.6	172.1	-67.2	173.4	0	0	0	111.4	I206 I230 S231 N241 L244 L247 L262 A265 N269	I206-L234 HydrophobicContact CD1-CD2 4.25Å; I206-L234 HydrophobicContact CG2-CD2 4.31Å; I230-L234 HydrophobicContact CG2-CD1 4.12Å; I230-L234 HydrophobicContact CG2-CG 4.39Å; I230-L234 WeakPolarHBondContact O-CG 3.34Å; I230-L234 PolarHBondContact O-N 3Å; S231-L234 WeakPolarHBondContact O-CB 3.34Å; S231-L234 PolarHBondContact O-N 2.91Å; L234-N241 PolarHBondContact O-N 3.03Å; L234-L244 HydrophobicContact CD2-CD2 3.64Å; L234-L247 HydrophobicContact CD1-CD2 3.66Å; L234-L247 HydrophobicContact CD2-CD2 4.18Å; L234-L247 HydrophobicContact CG-CD2 4.45Å; L234-L262 HydrophobicContact CD1-CD2 3.88Å; L234-A265 HydrophobicContact CB-CB 4.05Å; L234-N269 PolarHBondContact O-ND2 2.72Å
235	G	95.6	Very high	96.4	Very high	5 Å²	5	50.8 Å²	50.8	5%	0.052	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-169.9	134.6	-174.1	0	0	0	0	0	113.3	S231 Y239 A265	S231-G235 PolarHBondContact O-N 2.87Å; G235-Y239 CarbonylContact C-O 3.54Å; G235-Y239 WeakPolarHBondContact CA-O 3.26Å; G235-A265 WeakPolarHBondContact O-CA 3.42Å
236	T	94.6	Very high	96.4	Very high	50 Å²	50	49.4 Å²	49.4	31%	0.307	23%	0.233	S	C	.	.			trans	-132.8	-178.1	165.7	65.4	0	0	0	0	107.7	Q232 Q238 Y239 T268	Q232-T236 HydrophobicContact CB-CG2 4.5Å; T236-Q238 PolarHBondContact O-N 2.76Å; T236-Q238 PolarHBondContact OG1-N 2.62Å; T236-Y239 PolarHBondContact N-O 2.81Å; T236-Y239 PolarHBondContact OG1-N 3.07Å; T236-Y239 PolarHBondContact OG1-O 2.99Å; T236-T268 PolarHBondContact N-OG1 2.9Å; T236-T268 WeakPolarHBondContact O-CB 3.32Å; T236-T268 WeakPolarHBondContact O-CG2 3.44Å; T236-T268 PolarHBondContact O-OG1 3.37Å
237	M	91.3	Very high	96.4	Very high	48 Å²	48	47.6 Å²	47.6	24%	0.236	23%	0.225	C	C	.	.	S	Bend	trans	-64.6	-30.5	172	-64.6	-174.3	-78.1	0	0	112.7	E302 E303 Y306 N431 I433	M237-E302 HydrophobicContact CE-CB 4.07Å; M237-E303 HydrophobicContact CG-CG 4.32Å; M237-E303 HydrophobicContact SD-CB 4.23Å; M237-E303 HydrophobicContact SD-CG 3.67Å; M237-Y306 HydrophobicContact CB-CD1 4.09Å; M237-Y306 HydrophobicContact CB-CD2 4.21Å; M237-Y306 HydrophobicContact CB-CE1 4.27Å; M237-Y306 HydrophobicContact CB-CE2 4.37Å; M237-Y306 HydrophobicContact CB-CG 4.07Å; M237-Y306 WeakPolarHBondContact O-CE1 3.48Å; M237-Y306 PolarHBondContact O-OH 3.03Å; M237-Y306 VanDerWaalsContact O-OH 3.07Å; M237-Y306 HydrophobicContact SD-CD1 4.49Å; M237-Y306 HydrophobicContact SD-CG 4.1Å; M237-N431 PolarHBondContact O-ND2 3.14Å; M237-I433 HydrophobicContact CB-CD1 4.26Å; M237-I433 HydrophobicContact CG-CD1 3.64Å; M237-I433 HydrophobicContact SD-CD1 4.39Å
238	Q	89.7	Confident	96.4	Very high	170 Å²	170	48.4 Å²	48.4	79%	0.794	23%	0.229	S	C	*	.	S	Bend	trans	-99.2	-23.6	-172.1	-62.6	176.4	20.3	0	0	113.5	T236 Y306	T236-Q238 PolarHBondContact O-N 2.76Å; T236-Q238 PolarHBondContact OG1-N 2.62Å; Q238-Y306 HydrophobicContact CG-CE2 4.15Å
239	Y	92.1	Very high	96.4	Very high	60 Å²	60	45.1 Å²	45.1	24%	0.235	22%	0.215	C	C	.	.			trans	-142.4	139.4	-173.4	169.5	-96.3	0	0	0	110.6	E208 R233 G235 T236	E208-Y239 HydrophobicContact CB-CE2 3.91Å; E208-Y239 WeakPolarHBondContact CB-OH 3.34Å; R233-Y239 WeakPolarHBondContact O-CE1 3.37Å; G235-Y239 CarbonylContact C-O 3.54Å; G235-Y239 WeakPolarHBondContact CA-O 3.26Å; T236-Y239 PolarHBondContact N-O 2.81Å; T236-Y239 PolarHBondContact OG1-N 3.07Å; T236-Y239 PolarHBondContact OG1-O 2.99Å
240	V	94	Very high	96.5	Very high	27 Å²	27	44.9 Å²	44.9	16%	0.164	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-138.2	133.7	176.2	176	0	0	0	0	109.2	K242 N269	V240-K242 PolarHBondContact O-N 3Å; V240-N269 HydrophobicContact CG1-CB 4.2Å
241	N	95.9	Very high	96.4	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.218	C	C	.	.			trans	-70.9	119	170.1	-171.8	-59.5	0	0	0	110.2	I206 R233 L234 K243 L244 N269 T271	I206-N241 HydrophobicContact CG2-CB 4.35Å; I206-N241 VanDerWaalsContact CG2-ND2 3.35Å; I206-N241 WeakPolarHBondContact CG2-ND2 3.46Å; R233-N241 WeakPolarHBondContact O-CB 3.25Å; L234-N241 PolarHBondContact O-N 3.03Å; N241-K243 PolarHBondContact OD1-N 2.9Å; N241-L244 PolarHBondContact OD1-N 2.93Å; N241-N269 PolarHBondContact O-ND2 2.98Å; N241-T271 WeakPolarHBondContact O-CB 3.1Å; N241-T271 PolarHBondContact O-OG1 3.31Å
242	K	95.4	Very high	96.5	Very high	143 Å²	143	45.4 Å²	45.4	62%	0.622	22%	0.218	S	C	*	.	S	Bend	trans	-96.5	4.9	-175.2	-58.4	-178.8	-175.5	176.2	0	114.3	V240 T271	V240-K242 PolarHBondContact O-N 3Å; K242-T271 WeakPolarHBondContact CA-OG1 3.39Å; K242-T271 WeakPolarHBondContact O-CG2 3.2Å
243	K	96.9	Very high	96.4	Very high	67 Å²	67	44.7 Å²	44.7	29%	0.291	21%	0.214	S	C	.	.	S	Bend	trans	-120.5	-35.5	-171.6	-64.9	173.3	176.5	167.6	0	113.7	E208 N210 L212 T213 N241 I245	E208-K243 PolarHBondContact O-NZ 2.88Å; N210-K243 WeakPolarHBondContact O-CD 3.23Å; N210-K243 WeakPolarHBondContact O-CE 3.25Å; N210-K243 PolarHBondContact O-NZ 3.1Å; L212-K243 CarbonylContact O-C 3.59Å; T213-K243 WeakPolarHBondContact CA-O 3.45Å; N241-K243 PolarHBondContact OD1-N 2.9Å; K243-I245 PolarHBondContact O-N 2.85Å
244	L	98.1	Very high	96.5	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.016	20%	0.196	C	C	.	.			trans	-74.3	115.5	-176.1	-165.7	72.4	0	0	0	110.9	I206 L212 L215 L234 N241 L247 L272	I206-L244 HydrophobicContact CD1-CD2 4.32Å; I206-L244 HydrophobicContact CG1-CD2 4.5Å; I206-L244 HydrophobicContact CG2-CD2 4.47Å; L212-L244 HydrophobicContact CB-CD1 4.5Å; L215-L244 HydrophobicContact CB-CD1 3.75Å; L215-L244 HydrophobicContact CB-CD2 4.46Å; L234-L244 HydrophobicContact CD2-CD2 3.64Å; N241-L244 PolarHBondContact OD1-N 2.93Å; L244-L247 HydrophobicContact CD2-CB 4.21Å; L244-L247 HydrophobicContact CD2-CD1 4.35Å; L244-L272 HydrophobicContact CD2-CD1 4.41Å; L244-L272 HydrophobicContact CG-CD1 4.3Å
245	I	98.3	Very high	96.5	Very high	69 Å²	69	40.3 Å²	40.3	35%	0.354	20%	0.203	S	C	.	.			trans	-103.1	-32.7	-176.4	-67.5	166.5	0	0	0	110.8	T213 K243 L273 T274	T213-I245 PolarHBondContact O-N 3.49Å; K243-I245 PolarHBondContact O-N 2.85Å; I245-L273 HydrophobicContact CG2-CB 3.79Å; I245-L273 HydrophobicContact CG2-CD1 3.59Å; I245-L273 HydrophobicContact CG2-CG 3.75Å; I245-L273 PolarHBondContact O-N 3Å; I245-T274 PolarHBondContact O-N 2.99Å
246	N	98.8	Very high	96.7	Very high	49 Å²	49	41.5 Å²	41.5	26%	0.262	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.1	-178.1	-177.1	-50.8	0	0	0	111.3	T213 K214 L215 T274	T213-N246 PolarHBondContact O-N 3.1Å; K214-N246 WeakPolarHBondContact CA-O 3.43Å; K214-N246 HydrophobicContact CB-CB 4.22Å; K214-N246 HydrophobicContact CG-CB 4.01Å; L215-N246 PolarHBondContact N-O 2.97Å; N246-T274 VanDerWaalsContact CA-OG1 3.23Å; N246-T274 WeakPolarHBondContact CA-OG1 3.48Å; N246-T274 WeakPolarHBondContact CB-OG1 3.46Å; N246-T274 PolarHBondContact ND2-OG1 3.04Å
247	L	98.8	Very high	96.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.9	174	-179.6	61.3	0	0	0	110.4	L215 I230 L234 L244 L249 L272 T274 L275 S276	L215-L247 HydrophobicContact CB-CD1 4.22Å; L215-L247 HydrophobicContact CD2-CD1 4.23Å; L215-L247 HydrophobicContact CG-CD1 4.25Å; L215-L247 WeakPolarHBondContact O-CA 3.43Å; I230-L247 HydrophobicContact CG2-CD2 4.18Å; L234-L247 HydrophobicContact CD1-CD2 3.66Å; L234-L247 HydrophobicContact CD2-CD2 4.18Å; L234-L247 HydrophobicContact CG-CD2 4.45Å; L244-L247 HydrophobicContact CD2-CB 4.21Å; L244-L247 HydrophobicContact CD2-CD1 4.35Å; L247-L249 HydrophobicContact CD1-CD2 3.93Å; L247-L249 HydrophobicContact CD1-CG 4.11Å; L247-L249 HydrophobicContact CD2-CD1 4.05Å; L247-L249 HydrophobicContact CD2-CG 4.23Å; L247-L249 HydrophobicContact CG-CD1 4.33Å; L247-L249 HydrophobicContact CG-CD2 4.35Å; L247-L249 HydrophobicContact CG-CG 3.97Å; L247-L272 HydrophobicContact CB-CD1 3.81Å; L247-L272 HydrophobicContact CB-CD2 4.32Å; L247-T274 PolarHBondContact N-O 3.45Å; L247-L275 HydrophobicContact CB-CD1 4.27Å; L247-L275 HydrophobicContact CD2-CD1 4.15Å; L247-L275 HydrophobicContact CG-CD1 4.24Å; L247-L275 WeakPolarHBondContact O-CA 3.21Å; L247-S276 PolarHBondContact O-N 3.47Å
248	D	98.8	Very high	97.2	Very high	16 Å²	16	41.4 Å²	41.4	9%	0.086	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	106.8	177.8	179.1	5	0	0	0	110.1	L215 R216 L217 R218 S250	L215-D248 PolarHBondContact O-N 2.84Å; R216-D248 WeakPolarHBondContact CA-O 3.48Å; R216-D248 HydrophobicContact CB-CB 4.15Å; R216-D248 HydrophobicContact CG-CB 3.88Å; R216-D248 IonicContact NE-OD2 3.26Å; R216-D248 PolarHBondContact NE-OD2 2.99Å; R216-D248 VanDerWaalsContact NE-OD2 3.12Å; L217-D248 PolarHBondContact N-O 3.3Å; R218-D248 WeakPolarHBondContact CD-OD2 3.33Å; D248-S250 VanDerWaalsContact OD1-CB 3.28Å; D248-S250 WeakPolarHBondContact OD1-CB 3.41Å; D248-S250 PolarHBondContact OD1-N 3.12Å; D248-S250 VanDerWaalsContact OD1-N 3.1Å; D248-S250 PolarHBondContact OD1-OG 2.95Å
249	L	98.8	Very high	97.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.			trans	-109.7	24.7	178.4	-61	178.4	0	0	0	111.4	L217 I222 I230 L247 N252 L254 L262 S276 N280	L217-L249 HydrophobicContact CB-CD2 4Å; L217-L249 HydrophobicContact CD1-CD2 4.13Å; I222-L249 HydrophobicContact CD1-CD2 4.1Å; I230-L249 HydrophobicContact CD1-CD2 4.16Å; L247-L249 HydrophobicContact CD1-CD2 3.93Å; L247-L249 HydrophobicContact CD1-CG 4.11Å; L247-L249 HydrophobicContact CD2-CD1 4.05Å; L247-L249 HydrophobicContact CD2-CG 4.23Å; L247-L249 HydrophobicContact CG-CD1 4.33Å; L247-L249 HydrophobicContact CG-CD2 4.35Å; L247-L249 HydrophobicContact CG-CG 3.97Å; L249-N252 VanDerWaalsContact C-ND2 3.32Å; L249-N252 PolarHBondContact O-ND2 3.42Å; L249-L254 HydrophobicContact CB-CD1 4.31Å; L249-L254 HydrophobicContact CD1-CD1 4.41Å; L249-L254 HydrophobicContact CD1-CD2 4.41Å; L249-L262 HydrophobicContact CD1-CD1 4.04Å; L249-L262 HydrophobicContact CD1-CD2 4.23Å; L249-S276 PolarHBondContact N-O 3.27Å; L249-N280 PolarHBondContact O-ND2 2.94Å
250	S	98.7	Very high	98	Very high	13 Å²	13	33.2 Å²	33.2	9%	0.091	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	145.2	-174.3	-47.6	0	0	0	0	112.6	R218 Y219 D248 S276 S278	R218-S250 WeakPolarHBondContact CA-O 3.35Å; R218-S250 WeakPolarHBondContact CB-O 3.45Å; R218-S250 WeakPolarHBondContact CG-O 3.38Å; Y219-S250 PolarHBondContact N-O 2.71Å; D248-S250 VanDerWaalsContact OD1-CB 3.28Å; D248-S250 WeakPolarHBondContact OD1-CB 3.41Å; D248-S250 PolarHBondContact OD1-N 3.12Å; D248-S250 VanDerWaalsContact OD1-N 3.1Å; D248-S250 PolarHBondContact OD1-OG 2.95Å; S250-S276 WeakPolarHBondContact OG-CB 3.14Å; S250-S276 PolarHBondContact OG-OG 3.18Å; S250-S278 CarbonylContact C-O 3.37Å; S250-S278 WeakPolarHBondContact CA-O 3.41Å; S250-S278 WeakPolarHBondContact CB-O 3.15Å
251	G	98.3	Very high	98.2	Very high	10 Å²	10	33.8 Å²	33.8	10%	0.103	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	27.7	175.5	0	0	0	0	0	114.6	Y219 S278 N279	Y219-G251 VanDerWaalsContact CA-O 3.3Å; Y219-G251 WeakPolarHBondContact CA-O 3.37Å; Y219-G251 WeakPolarHBondContact CD1-O 3.5Å; G251-S278 PolarHBondContact N-O 2.95Å; G251-N279 CarbonylContact C-O 3.53Å; G251-N279 WeakPolarHBondContact CA-O 3.49Å; G251-N279 PolarHBondContact N-O 3.42Å
252	N	98.6	Very high	98.3	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.027	17%	0.168	C	C	.	.	S	Bend	trans	-106.2	-159.1	173.3	-69.3	-66	0	0	0	110.4	L217 C220 E221 I222 L249 N279 N280	L217-N252 PolarHBondContact O-ND2 2.84Å; C220-N252 WeakPolarHBondContact CA-OD1 3.36Å; C220-N252 PolarHBondContact N-OD1 3.45Å; E221-N252 PolarHBondContact N-OD1 3.12Å; I222-N252 HydrophobicContact CB-CB 3.9Å; I222-N252 PolarHBondContact N-OD1 2.9Å; I222-N252 WeakPolarHBondContact O-CB 3.37Å; L249-N252 VanDerWaalsContact C-ND2 3.32Å; L249-N252 PolarHBondContact O-ND2 3.42Å; N252-N279 PolarHBondContact N-O 2.81Å; N252-N280 WeakPolarHBondContact CA-OD1 3.47Å; N252-N280 WeakPolarHBondContact CB-OD1 3.36Å; N252-N280 PolarHBondContact N-OD1 3.21Å; N252-N280 VanDerWaalsContact N-OD1 3.16Å; N252-N280 PolarHBondContact O-OD1 3.13Å
253	Q	97.7	Very high	98.5	Very high	91 Å²	91	27.1 Å²	27.1	43%	0.425	14%	0.14	S	C	.	.			trans	-131.9	40.2	-173.2	-54.4	-176.7	59.1	0	0	110.9	I222 G255 N280	I222-Q253 CarbonylContact O-C 3.19Å; I222-Q253 WeakPolarHBondContact O-CA 3.06Å; I222-Q253 PolarHBondContact O-N 2.86Å; Q253-G255 VanDerWaalsContact C-N 3.25Å; Q253-G255 PolarHBondContact O-N 3.37Å; Q253-N280 PolarHBondContact N-OD1 2.69Å
254	L	98.5	Very high	98.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.			trans	-56.8	-39.5	-176.1	-55.9	167.5	0	0	0	112.2	I222 P224 A227 L249 G258 L262 V277 N280	I222-L254 HydrophobicContact CG2-CD2 3.8Å; P224-L254 WeakPolarHBondContact CG-O 3.47Å; A227-L254 HydrophobicContact CB-CD2 3.41Å; A227-L254 VanDerWaalsContact CB-CD2 3.41Å; L249-L254 HydrophobicContact CB-CD1 4.31Å; L249-L254 HydrophobicContact CD1-CD1 4.41Å; L249-L254 HydrophobicContact CD1-CD2 4.41Å; L254-G258 VanDerWaalsContact O-CA 3.27Å; L254-G258 WeakPolarHBondContact O-CA 3.36Å; L254-G258 PolarHBondContact O-N 2.97Å; L254-L262 HydrophobicContact CD1-CD1 4.05Å; L254-V277 HydrophobicContact CD1-CB 4.11Å; L254-V277 HydrophobicContact CD1-CG1 3.77Å; L254-N280 HydrophobicContact CB-CB 4.15Å; L254-N280 HydrophobicContact CD1-CB 3.94Å; L254-N280 VanDerWaalsContact CD1-CG 3.43Å; L254-N280 WeakPolarHBondContact CD1-OD1 3.49Å; L254-N280 HydrophobicContact CG-CB 4.15Å; L254-N280 WeakPolarHBondContact CG-OD1 3.47Å
255	G	98.6	Very high	98.5	Very high	17 Å²	17	29 Å²	29	18%	0.175	15%	0.15	C	C	.	.	H	α-helix	trans	60.8	-171.5	-170.6	0	0	0	0	0	112.8	Q253 E257 T259 N280	Q253-G255 VanDerWaalsContact C-N 3.25Å; Q253-G255 PolarHBondContact O-N 3.37Å; G255-E257 VanDerWaalsContact C-N 3.35Å; G255-T259 WeakPolarHBondContact O-CB 3.14Å; G255-T259 PolarHBondContact O-N 3.37Å; G255-T259 PolarHBondContact O-OG1 3.37Å; G255-N280 WeakPolarHBondContact CA-O 3.34Å; G255-N280 PolarHBondContact N-O 2.98Å
256	D	98.8	Very high	98.5	Very high	30 Å²	30	26 Å²	26	16%	0.16	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-40.5	175.4	-66.7	-44.7	0	0	0	111.8	T259 I260 T283 I285 G286	D256-T259 CarbonylContact O-C 3.55Å; D256-T259 WeakPolarHBondContact O-CB 3.4Å; D256-T259 PolarHBondContact O-N 3.46Å; D256-I260 VanDerWaalsContact O-CG1 3.27Å; D256-I260 WeakPolarHBondContact O-CG1 3.27Å; D256-I260 PolarHBondContact O-N 2.83Å; D256-T283 VanDerWaalsContact CG-OG1 3.23Å; D256-T283 PolarHBondContact OD1-N 3.08Å; D256-T283 PolarHBondContact OD1-OG1 2.83Å; D256-T283 WeakPolarHBondContact OD2-CB 3.49Å; D256-T283 WeakPolarHBondContact OD2-CG2 3.35Å; D256-T283 PolarHBondContact OD2-OG1 2.56Å; D256-I285 HydrophobicContact CB-CB 4.11Å; D256-I285 HydrophobicContact CB-CG2 4.13Å; D256-G286 WeakPolarHBondContact OD1-CA 3.49Å; D256-G286 PolarHBondContact OD1-N 3.27Å
257	E	98.7	Very high	98.4	Very high	96 Å²	96	25.1 Å²	25.1	45%	0.449	13%	0.128	S	C	.	.	H	α-helix	trans	-61.1	-50.2	-179.4	-170.9	-171.4	173.2	0	0	112	P224 G255 T259 I260 Y261	P224-E257 HydrophobicContact CB-CB 4.08Å; P224-E257 HydrophobicContact CB-CG 4.2Å; G255-E257 VanDerWaalsContact C-N 3.35Å; E257-T259 PolarHBondContact O-N 2.98Å; E257-I260 PolarHBondContact O-N 3.07Å; E257-Y261 HydrophobicContact CG-CD2 4.48Å; E257-Y261 HydrophobicContact CG-CE2 3.71Å; E257-Y261 VanDerWaalsContact O-CD2 3.27Å; E257-Y261 WeakPolarHBondContact O-CD2 3.48Å; E257-Y261 PolarHBondContact O-N 3.29Å; E257-Y261 PolarHBondContact OE1-OH 3.32Å
258	G	98.7	Very high	98.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61	-34.7	175.8	0	0	0	0	0	112.9	L254 Y261 L262	L254-G258 VanDerWaalsContact O-CA 3.27Å; L254-G258 WeakPolarHBondContact O-CA 3.36Å; L254-G258 PolarHBondContact O-N 2.97Å; G258-Y261 PolarHBondContact O-N 3.21Å; G258-L262 PolarHBondContact O-N 2.95Å
259	T	98.8	Very high	98.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-70.7	-35.5	177.3	-56.9	0	0	0	0	112.3	G255 D256 E257 L262 A263 I282 G286 L290	G255-T259 WeakPolarHBondContact O-CB 3.14Å; G255-T259 PolarHBondContact O-N 3.37Å; G255-T259 PolarHBondContact O-OG1 3.37Å; D256-T259 CarbonylContact O-C 3.55Å; D256-T259 WeakPolarHBondContact O-CB 3.4Å; D256-T259 PolarHBondContact O-N 3.46Å; E257-T259 PolarHBondContact O-N 2.98Å; T259-L262 PolarHBondContact O-N 3.25Å; T259-A263 PolarHBondContact O-N 3.05Å; T259-I282 HydrophobicContact CG2-CD1 4.15Å; T259-I282 HydrophobicContact CG2-CG2 4.39Å; T259-I282 VanDerWaalsContact OG1-CD1 3.26Å; T259-I282 WeakPolarHBondContact OG1-CD1 3.31Å; T259-I282 WeakPolarHBondContact OG1-CG1 3.49Å; T259-G286 WeakPolarHBondContact CG2-O 3.16Å; T259-L290 HydrophobicContact CG2-CD1 3.57Å; T259-L290 HydrophobicContact CG2-CD2 4.46Å; T259-L290 HydrophobicContact CG2-CG 3.77Å
260	I	98.8	Very high	97.8	Very high	58 Å²	58	26.5 Å²	26.5	30%	0.297	13%	0.132	S	C	.	.	H	α-helix	trans	-62.4	-43.8	173.9	-71.5	162	0	0	0	110.3	D256 E257 L262 A263 E264 I285 A289	D256-I260 VanDerWaalsContact O-CG1 3.27Å; D256-I260 WeakPolarHBondContact O-CG1 3.27Å; D256-I260 PolarHBondContact O-N 2.83Å; E257-I260 PolarHBondContact O-N 3.07Å; I260-L262 VanDerWaalsContact C-N 3.32Å; I260-L262 PolarHBondContact O-N 2.8Å; I260-A263 WeakPolarHBondContact O-CB 3.24Å; I260-A263 PolarHBondContact O-N 3.29Å; I260-A263 VanDerWaalsContact O-N 3.14Å; I260-E264 WeakPolarHBondContact O-CG 3.32Å; I260-E264 PolarHBondContact O-N 2.92Å; I260-I285 HydrophobicContact CD1-CG2 4.25Å; I260-A289 HydrophobicContact CG1-CB 3.84Å
261	Y	98.7	Very high	97.7	Very high	39 Å²	39	26.8 Å²	26.8	15%	0.153	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-40.2	175	-62.6	-52.8	0	0	0	112.3	K228 S231 E257 G258 A263 E264 A265	K228-Y261 HydrophobicContact CB-CD1 4.33Å; K228-Y261 HydrophobicContact CB-CD2 3.5Å; K228-Y261 VanDerWaalsContact CB-CD2 3.5Å; K228-Y261 HydrophobicContact CB-CE2 3.73Å; K228-Y261 HydrophobicContact CB-CG 3.84Å; K228-Y261 HydrophobicContact CD-CD1 4.35Å; K228-Y261 HydrophobicContact CD-CD2 4.45Å; K228-Y261 HydrophobicContact CD-CE1 3.87Å; K228-Y261 HydrophobicContact CD-CE2 3.99Å; K228-Y261 HydrophobicContact CG-CD1 3.91Å; K228-Y261 HydrophobicContact CG-CD2 3.98Å; K228-Y261 HydrophobicContact CG-CE1 3.95Å; K228-Y261 HydrophobicContact CG-CE2 4.04Å; K228-Y261 HydrophobicContact CG-CG 3.93Å; S231-Y261 VanDerWaalsContact CB-O 3.27Å; S231-Y261 WeakPolarHBondContact CB-O 3.28Å; S231-Y261 PolarHBondContact OG-O 2.91Å; E257-Y261 HydrophobicContact CG-CD2 4.48Å; E257-Y261 HydrophobicContact CG-CE2 3.71Å; E257-Y261 VanDerWaalsContact O-CD2 3.27Å; E257-Y261 WeakPolarHBondContact O-CD2 3.48Å; E257-Y261 PolarHBondContact O-N 3.29Å; E257-Y261 PolarHBondContact OE1-OH 3.32Å; G258-Y261 PolarHBondContact O-N 3.21Å; Y261-A263 VanDerWaalsContact C-N 3.34Å; Y261-A263 PolarHBondContact O-N 2.98Å; Y261-E264 WeakPolarHBondContact O-CB 3.42Å; Y261-E264 PolarHBondContact O-N 2.8Å; Y261-A265 PolarHBondContact O-N 2.99Å
262	L	98.7	Very high	97.7	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-63.1	-41.8	174.4	-73	170.8	0	0	0	111.4	S231 L234 L249 L254 G258 T259 I260 A265 L266 V277	S231-L262 WeakPolarHBondContact OG-CA 3.1Å; S231-L262 WeakPolarHBondContact OG-CD2 3.45Å; S231-L262 PolarHBondContact OG-N 2.88Å; L234-L262 HydrophobicContact CD1-CD2 3.88Å; L249-L262 HydrophobicContact CD1-CD1 4.04Å; L249-L262 HydrophobicContact CD1-CD2 4.23Å; L254-L262 HydrophobicContact CD1-CD1 4.05Å; G258-L262 PolarHBondContact O-N 2.95Å; T259-L262 PolarHBondContact O-N 3.25Å; I260-L262 VanDerWaalsContact C-N 3.32Å; I260-L262 PolarHBondContact O-N 2.8Å; L262-A265 PolarHBondContact O-N 2.99Å; L262-L266 VanDerWaalsContact O-CG 3.3Å; L262-L266 WeakPolarHBondContact O-CG 3.33Å; L262-L266 PolarHBondContact O-N 3.26Å; L262-V277 HydrophobicContact CD1-CG1 3.77Å
263	A	98.5	Very high	97.6	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.033	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-44.8	175.2	0	0	0	0	0	111.1	T259 I260 Y261 A265 L266 R267 A289 L290 V293	T259-A263 PolarHBondContact O-N 3.05Å; I260-A263 WeakPolarHBondContact O-CB 3.24Å; I260-A263 PolarHBondContact O-N 3.29Å; I260-A263 VanDerWaalsContact O-N 3.14Å; Y261-A263 VanDerWaalsContact C-N 3.34Å; Y261-A263 PolarHBondContact O-N 2.98Å; A263-A265 PolarHBondContact O-N 3.2Å; A263-L266 PolarHBondContact O-N 3.35Å; A263-L266 VanDerWaalsContact O-N 3.14Å; A263-R267 PolarHBondContact O-N 3.29Å; A263-R267 VanDerWaalsContact O-N 3.16Å; A263-A289 HydrophobicContact CB-CB 4.02Å; A263-L290 HydrophobicContact CB-CD2 4.1Å; A263-V293 HydrophobicContact CB-CG2 4.01Å; A263-V293 WeakPolarHBondContact O-CG2 3.5Å
264	E	97.7	Very high	97.7	Very high	108 Å²	108	26.6 Å²	26.6	51%	0.505	13%	0.134	S	C	.	.	H	α-helix	trans	-57.1	-46	175.2	-72.7	174.7	174.6	0	0	112.1	I260 Y261 L266 R267	I260-E264 WeakPolarHBondContact O-CG 3.32Å; I260-E264 PolarHBondContact O-N 2.92Å; Y261-E264 WeakPolarHBondContact O-CB 3.42Å; Y261-E264 PolarHBondContact O-N 2.8Å; E264-L266 VanDerWaalsContact C-N 3.31Å; E264-L266 PolarHBondContact O-N 2.92Å; E264-R267 VanDerWaalsContact O-CB 3.26Å; E264-R267 WeakPolarHBondContact O-CB 3.4Å; E264-R267 PolarHBondContact O-N 3.07Å; E264-R267 VanDerWaalsContact O-N 3.11Å
265	A	97.8	Very high	97.7	Very high	3 Å²	3	26.6 Å²	26.6	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-63.4	-36.7	176.2	0	0	0	0	0	112.8	S231 L234 G235 Y261 L262 A263 R267 T268 N269	S231-A265 VanDerWaalsContact O-CB 3.23Å; S231-A265 WeakPolarHBondContact O-CB 3.25Å; L234-A265 HydrophobicContact CB-CB 4.05Å; G235-A265 WeakPolarHBondContact O-CA 3.42Å; Y261-A265 PolarHBondContact O-N 2.99Å; L262-A265 PolarHBondContact O-N 2.99Å; A263-A265 PolarHBondContact O-N 3.2Å; A265-R267 PolarHBondContact O-N 3.44Å; A265-T268 PolarHBondContact O-N 2.82Å; A265-T268 PolarHBondContact O-OG1 3.39Å; A265-N269 WeakPolarHBondContact O-CB 3.45Å; A265-N269 PolarHBondContact O-N 2.85Å
266	L	97.6	Very high	97.7	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-70.2	-12.9	176.4	-71.4	174.7	0	0	0	113.5	L262 A263 E264 T268 R270 L272 L275 L290 V293 N450 L453	L262-L266 VanDerWaalsContact O-CG 3.3Å; L262-L266 WeakPolarHBondContact O-CG 3.33Å; L262-L266 PolarHBondContact O-N 3.26Å; A263-L266 PolarHBondContact O-N 3.35Å; A263-L266 VanDerWaalsContact O-N 3.14Å; E264-L266 VanDerWaalsContact C-N 3.31Å; E264-L266 PolarHBondContact O-N 2.92Å; L266-T268 VanDerWaalsContact C-N 3.26Å; L266-T268 PolarHBondContact O-N 3.35Å; L266-R270 PolarHBondContact O-NH1 3.06Å; L266-L272 HydrophobicContact CD2-CB 4.46Å; L266-L272 HydrophobicContact CD2-CD2 4.06Å; L266-L275 HydrophobicContact CD1-CD2 3.93Å; L266-L290 HydrophobicContact CD1-CD2 3.93Å; L266-V293 HydrophobicContact CB-CG1 3.75Å; L266-N450 PolarHBondContact O-ND2 3.17Å; L266-L453 HydrophobicContact CD1-CD2 4.35Å
267	R	96.5	Very high	97.7	Very high	31 Å²	31	24.9 Å²	24.9	12%	0.117	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-32.6	171.4	-63.8	171.2	68.1	84.4	-3.7	111.6	A263 E264 A265 R270 V293 F297 F298 E303	A263-R267 PolarHBondContact O-N 3.29Å; A263-R267 VanDerWaalsContact O-N 3.16Å; E264-R267 VanDerWaalsContact O-CB 3.26Å; E264-R267 WeakPolarHBondContact O-CB 3.4Å; E264-R267 PolarHBondContact O-N 3.07Å; E264-R267 VanDerWaalsContact O-N 3.11Å; A265-R267 PolarHBondContact O-N 3.44Å; R267-R270 VanDerWaalsContact O-CZ 3.32Å; R267-R270 PolarHBondContact O-NH1 3.05Å; R267-R270 PolarHBondContact O-NH2 3.12Å; R267-V293 HydrophobicContact CG-CG1 4.28Å; R267-V293 HydrophobicContact CG-CG2 3.82Å; R267-F297 HydrophobicContact CB-CE1 4.48Å; R267-F297 HydrophobicContact CB-CE2 4.32Å; R267-F297 HydrophobicContact CB-CZ 3.86Å; R267-F297 HydrophobicContact CG-CE1 4.31Å; R267-F297 HydrophobicContact CG-CE2 4.32Å; R267-F297 HydrophobicContact CG-CZ 4.03Å; R267-F297 VanDerWaalsContact NH1-CG 3.27Å; R267-F297 VanDerWaalsContact NH2-CE2 3.28Å; R267-F298 PolarHBondContact NH2-O 3.09Å; R267-E303 IonicContact CZ-OE1 3.4Å; R267-E303 IonicContact CZ-OE2 3.56Å; R267-E303 IonicContact NE-OE1 2.72Å; R267-E303 PolarHBondContact NE-OE1 3.38Å; R267-E303 IonicContact NE-OE2 3.68Å; R267-E303 VanDerWaalsContact NH2-CD 3.34Å; R267-E303 IonicContact NH2-OE1 3.24Å; R267-E303 PolarHBondContact NH2-OE1 3.12Å; R267-E303 IonicContact NH2-OE2 2.64Å; R267-E303 PolarHBondContact NH2-OE2 2.85Å
268	T	94.9	Very high	97.7	Very high	6 Å²	6	21 Å²	21	4%	0.037	11%	0.105	C	C	.	.	H	α-helix	trans	-109.6	-29.7	179	62.8	0	0	0	0	114.1	T236 A265 L266 R270 I433	T236-T268 PolarHBondContact N-OG1 2.9Å; T236-T268 WeakPolarHBondContact O-CB 3.32Å; T236-T268 WeakPolarHBondContact O-CG2 3.44Å; T236-T268 PolarHBondContact O-OG1 3.37Å; A265-T268 PolarHBondContact O-N 2.82Å; A265-T268 PolarHBondContact O-OG1 3.39Å; L266-T268 VanDerWaalsContact C-N 3.26Å; L266-T268 PolarHBondContact O-N 3.35Å; T268-R270 PolarHBondContact O-N 3.37Å; T268-I433 HydrophobicContact CG2-CD1 3.42Å; T268-I433 VanDerWaalsContact CG2-CD1 3.42Å; T268-I433 HydrophobicContact CG2-CG1 4.02Å
269	N	95.7	Very high	97.7	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.122	C	C	.	.			trans	-69.7	121.8	179.5	-170	-63.7	0	0	0	111.3	L234 V240 N241 A265 T271 L272 N450	L234-N269 PolarHBondContact O-ND2 2.72Å; V240-N269 HydrophobicContact CG1-CB 4.2Å; N241-N269 PolarHBondContact O-ND2 2.98Å; A265-N269 WeakPolarHBondContact O-CB 3.45Å; A265-N269 PolarHBondContact O-N 2.85Å; N269-T271 PolarHBondContact OD1-N 3.38Å; N269-L272 PolarHBondContact OD1-N 2.99Å; N269-N450 PolarHBondContact O-ND2 2.91Å
270	R	94.1	Very high	97.7	Very high	37 Å²	37	24.1 Å²	24.1	14%	0.14	12%	0.122	C	C	.	.			trans	-122.5	33.8	175.6	-65.4	-63.4	177.1	-82	-4.1	111.5	L266 R267 T268 L429 P432 N450 I452	L266-R270 PolarHBondContact O-NH1 3.06Å; R267-R270 VanDerWaalsContact O-CZ 3.32Å; R267-R270 PolarHBondContact O-NH1 3.05Å; R267-R270 PolarHBondContact O-NH2 3.12Å; T268-R270 PolarHBondContact O-N 3.37Å; R270-L429 HydrophobicContact CB-CD2 4.08Å; R270-P432 HydrophobicContact CG-CB 4.36Å; R270-P432 HydrophobicContact CG-CG 3.36Å; R270-N450 PolarHBondContact NH1-ND2 3.27Å; R270-I452 HydrophobicContact CB-CG1 3.92Å; R270-I452 HydrophobicContact CG-CG1 4.38Å
271	T	95.6	Very high	97.7	Very high	20 Å²	20	27.3 Å²	27.3	12%	0.123	13%	0.134	C	C	.	.			trans	-118.2	-39.9	179.8	-45.4	0	0	0	0	111.3	N241 K242 N269 L273	N241-T271 WeakPolarHBondContact O-CB 3.1Å; N241-T271 PolarHBondContact O-OG1 3.31Å; K242-T271 WeakPolarHBondContact CA-OG1 3.39Å; K242-T271 WeakPolarHBondContact O-CG2 3.2Å; N269-T271 PolarHBondContact OD1-N 3.38Å; T271-L273 PolarHBondContact O-N 3.48Å
272	L	97.7	Very high	97.7	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.01	13%	0.126	C	C	.	.			trans	-69.8	114.3	-174.5	-164.9	74.9	0	0	0	110.4	L244 L247 L266 N269 L275	L244-L272 HydrophobicContact CD2-CD1 4.41Å; L244-L272 HydrophobicContact CG-CD1 4.3Å; L247-L272 HydrophobicContact CB-CD1 3.81Å; L247-L272 HydrophobicContact CB-CD2 4.32Å; L266-L272 HydrophobicContact CD2-CB 4.46Å; L266-L272 HydrophobicContact CD2-CD2 4.06Å; N269-L272 PolarHBondContact OD1-N 2.99Å; L272-L275 HydrophobicContact CD2-CB 4.08Å; L272-L275 HydrophobicContact CD2-CD1 4.32Å
273	L	98	Very high	97.7	Very high	68 Å²	68	27.6 Å²	27.6	36%	0.356	14%	0.139	S	C	.	.			trans	-91.1	-30.9	178.4	-64.9	-179.4	0	0	0	112.2	I245 T271 I452 A454 F455	I245-L273 HydrophobicContact CG2-CB 3.79Å; I245-L273 HydrophobicContact CG2-CD1 3.59Å; I245-L273 HydrophobicContact CG2-CG 3.75Å; I245-L273 PolarHBondContact O-N 3Å; T271-L273 PolarHBondContact O-N 3.48Å; L273-I452 HydrophobicContact CD2-CG2 3.59Å; L273-I452 WeakPolarHBondContact CD2-O 3.39Å; L273-A454 PolarHBondContact O-N 3.44Å; L273-F455 PolarHBondContact O-N 3.44Å
274	T	98.6	Very high	97.7	Very high	31 Å²	31	28.8 Å²	28.8	19%	0.19	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	124.9	-174.9	73.5	0	0	0	0	111.3	I245 N246 L247 F455	I245-T274 PolarHBondContact O-N 2.99Å; N246-T274 VanDerWaalsContact CA-OG1 3.23Å; N246-T274 WeakPolarHBondContact CA-OG1 3.48Å; N246-T274 WeakPolarHBondContact CB-OG1 3.46Å; N246-T274 PolarHBondContact ND2-OG1 3.04Å; L247-T274 PolarHBondContact N-O 3.45Å; T274-F455 WeakPolarHBondContact CA-O 3.38Å; T274-F455 HydrophobicContact CG2-CB 3.76Å; T274-F455 HydrophobicContact CG2-CG 4.48Å
275	L	98.8	Very high	97.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.6	174.9	178.5	60.6	0	0	0	110	L247 L266 L272 V277 L453 F455 L456 N457	L247-L275 HydrophobicContact CB-CD1 4.27Å; L247-L275 HydrophobicContact CD2-CD1 4.15Å; L247-L275 HydrophobicContact CG-CD1 4.24Å; L247-L275 WeakPolarHBondContact O-CA 3.21Å; L266-L275 HydrophobicContact CD1-CD2 3.93Å; L272-L275 HydrophobicContact CD2-CB 4.08Å; L272-L275 HydrophobicContact CD2-CD1 4.32Å; L275-V277 HydrophobicContact CD1-CG1 3.99Å; L275-V277 HydrophobicContact CD2-CG1 4.37Å; L275-V277 HydrophobicContact CG-CG1 4.09Å; L275-L453 HydrophobicContact CB-CD1 3.93Å; L275-F455 PolarHBondContact N-O 3.5Å; L275-L456 HydrophobicContact CB-CD1 4.24Å; L275-L456 HydrophobicContact CD2-CD1 4.25Å; L275-L456 HydrophobicContact CG-CD1 4.27Å; L275-L456 WeakPolarHBondContact O-CA 3.44Å; L275-N457 PolarHBondContact O-N 3.34Å
276	S	98.8	Very high	97.8	Very high	11 Å²	11	28.5 Å²	28.5	8%	0.077	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.3	169.4	-168.7	0	0	0	0	110.4	L247 L249 S250 N457	L247-S276 PolarHBondContact O-N 3.47Å; L249-S276 PolarHBondContact N-O 3.27Å; S250-S276 WeakPolarHBondContact OG-CB 3.14Å; S250-S276 PolarHBondContact OG-OG 3.18Å; S276-N457 WeakPolarHBondContact OG-CB 3.15Å; S276-N457 PolarHBondContact OG-ND2 2.95Å; S276-N457 VanDerWaalsContact OG-ND2 3.13Å
277	V	98.8	Very high	97.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.144	C	C	.	.			trans	-125.6	30.6	174.3	-67.9	0	0	0	0	110	L254 L262 L275 N280 I282 N457 L458 N461	L254-V277 HydrophobicContact CD1-CB 4.11Å; L254-V277 HydrophobicContact CD1-CG1 3.77Å; L262-V277 HydrophobicContact CD1-CG1 3.77Å; L275-V277 HydrophobicContact CD1-CG1 3.99Å; L275-V277 HydrophobicContact CD2-CG1 4.37Å; L275-V277 HydrophobicContact CG-CG1 4.09Å; V277-N280 WeakPolarHBondContact CA-ND2 3.28Å; V277-N280 WeakPolarHBondContact O-CB 3.3Å; V277-N280 PolarHBondContact O-ND2 2.96Å; V277-I282 HydrophobicContact CB-CD1 3.94Å; V277-I282 HydrophobicContact CG2-CD1 3.71Å; V277-N457 CarbonylContact C-O 3.6Å; V277-N457 PolarHBondContact N-O 3.01Å; V277-L458 HydrophobicContact CG2-CD2 3.69Å; V277-N461 PolarHBondContact O-ND2 3.34Å; V277-N461 VanDerWaalsContact O-ND2 3.14Å
278	S	98.7	Very high	97.9	Very high	13 Å²	13	29.3 Å²	29.3	9%	0.091	15%	0.152	C	C	.	.			trans	-60.6	143.3	175.9	175.7	0	0	0	0	111.6	S250 G251 N280 N457 S459	S250-S278 CarbonylContact C-O 3.37Å; S250-S278 WeakPolarHBondContact CA-O 3.41Å; S250-S278 WeakPolarHBondContact CB-O 3.15Å; G251-S278 PolarHBondContact N-O 2.95Å; S278-N280 PolarHBondContact O-ND2 2.91Å; S278-N457 PolarHBondContact N-O 2.91Å; S278-S459 CarbonylContact C-O 3.57Å; S278-S459 WeakPolarHBondContact CA-O 3.4Å; S278-S459 VanDerWaalsContact CB-O 3.23Å; S278-S459 WeakPolarHBondContact CB-O 3.36Å; S278-S459 PolarHBondContact OG-O 3.27Å
279	N	98.5	Very high	98.1	Very high	66 Å²	66	30 Å²	30	35%	0.353	16%	0.158	S	C	.	.	S	Bend	trans	56.7	59	178.3	-167.3	43.1	0	0	0	113.4	G251 N252 S459 R460	G251-N279 CarbonylContact C-O 3.53Å; G251-N279 WeakPolarHBondContact CA-O 3.49Å; G251-N279 PolarHBondContact N-O 3.42Å; N252-N279 PolarHBondContact N-O 2.81Å; N279-S459 PolarHBondContact N-O 3.4Å; N279-R460 WeakPolarHBondContact CA-O 3.48Å; N279-R460 HydrophobicContact CB-CB 3.96Å; N279-R460 PolarHBondContact N-O 3.06Å
280	N	98.7	Very high	98.2	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	-130.9	14.9	-177.3	-85	-68.6	0	0	0	114.7	L249 N252 Q253 L254 G255 V277 S278 I282 N461	L249-N280 PolarHBondContact O-ND2 2.94Å; N252-N280 WeakPolarHBondContact CA-OD1 3.47Å; N252-N280 WeakPolarHBondContact CB-OD1 3.36Å; N252-N280 PolarHBondContact N-OD1 3.21Å; N252-N280 VanDerWaalsContact N-OD1 3.16Å; N252-N280 PolarHBondContact O-OD1 3.13Å; Q253-N280 PolarHBondContact N-OD1 2.69Å; L254-N280 HydrophobicContact CB-CB 4.15Å; L254-N280 HydrophobicContact CD1-CB 3.94Å; L254-N280 VanDerWaalsContact CD1-CG 3.43Å; L254-N280 WeakPolarHBondContact CD1-OD1 3.49Å; L254-N280 HydrophobicContact CG-CB 4.15Å; L254-N280 WeakPolarHBondContact CG-OD1 3.47Å; G255-N280 WeakPolarHBondContact CA-O 3.34Å; G255-N280 PolarHBondContact N-O 2.98Å; V277-N280 WeakPolarHBondContact CA-ND2 3.28Å; V277-N280 WeakPolarHBondContact O-CB 3.3Å; V277-N280 PolarHBondContact O-ND2 2.96Å; S278-N280 PolarHBondContact O-ND2 2.91Å; N280-I282 VanDerWaalsContact C-N 3.27Å; N280-I282 HydrophobicContact CB-CD1 4.04Å; N280-I282 HydrophobicContact CB-CG1 3.96Å; N280-I282 PolarHBondContact O-N 2.99Å; N280-N461 WeakPolarHBondContact CA-OD1 3.16Å; N280-N461 PolarHBondContact N-OD1 3.21Å
281	K	98.3	Very high	98.5	Very high	126 Å²	126	28.3 Å²	28.3	55%	0.548	15%	0.152	S	C	.	.			trans	59.5	34.7	-179.3	-50.7	173	-178.8	171.6	0	113.1	N461	K281-N461 PolarHBondContact N-OD1 3.37Å; K281-N461 VanDerWaalsContact N-OD1 3.09Å
282	I	98.8	Very high	98.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.			trans	-79.7	134.9	179.2	-57	174.4	0	0	0	109.5	T259 V277 N280 L458 N461 S462 I463	T259-I282 HydrophobicContact CG2-CD1 4.15Å; T259-I282 HydrophobicContact CG2-CG2 4.39Å; T259-I282 VanDerWaalsContact OG1-CD1 3.26Å; T259-I282 WeakPolarHBondContact OG1-CD1 3.31Å; T259-I282 WeakPolarHBondContact OG1-CG1 3.49Å; V277-I282 HydrophobicContact CB-CD1 3.94Å; V277-I282 HydrophobicContact CG2-CD1 3.71Å; N280-I282 VanDerWaalsContact C-N 3.27Å; N280-I282 HydrophobicContact CB-CD1 4.04Å; N280-I282 HydrophobicContact CB-CG1 3.96Å; N280-I282 PolarHBondContact O-N 2.99Å; I282-L458 HydrophobicContact CD1-CD2 4.26Å; I282-N461 HydrophobicContact CB-CB 4.03Å; I282-N461 WeakPolarHBondContact CB-OD1 3.29Å; I282-N461 WeakPolarHBondContact CG1-OD1 3.39Å; I282-N461 PolarHBondContact N-OD1 2.75Å; I282-N461 WeakPolarHBondContact O-CB 3.23Å; I282-S462 CarbonylContact O-C 3.55Å; I282-S462 VanDerWaalsContact O-C 3.27Å; I282-S462 WeakPolarHBondContact O-CA 3.23Å; I282-S462 PolarHBondContact O-N 3.08Å; I282-I463 HydrophobicContact CG2-CG1 4.41Å; I282-I463 PolarHBondContact O-N 3.4Å
283	T	98.8	Very high	98.5	Very high	47 Å²	47	33.7 Å²	33.7	29%	0.288	17%	0.174	S	C	.	.			trans	-106	-168.8	174.7	80	0	0	0	0	111.1	D256 I285 C287	D256-T283 VanDerWaalsContact CG-OG1 3.23Å; D256-T283 PolarHBondContact OD1-N 3.08Å; D256-T283 PolarHBondContact OD1-OG1 2.83Å; D256-T283 WeakPolarHBondContact OD2-CB 3.49Å; D256-T283 WeakPolarHBondContact OD2-CG2 3.35Å; D256-T283 PolarHBondContact OD2-OG1 2.56Å; T283-I285 PolarHBondContact O-N 2.8Å; T283-I285 PolarHBondContact OG1-N 2.86Å; T283-C287 WeakPolarHBondContact O-CB 3.46Å; T283-C287 PolarHBondContact O-N 2.84Å
284	D	98.7	Very high	98.4	Very high	29 Å²	29	30.7 Å²	30.7	16%	0.155	16%	0.158	C	C	.	.	H	α-helix	trans	-51.4	-35.3	170.6	-76.6	-17	0	0	0	112.3	C287 I288 G464 N466 G467	D284-C287 PolarHBondContact O-N 3.31Å; D284-I288 HydrophobicContact CB-CD1 4.35Å; D284-I288 VanDerWaalsContact O-CB 3.3Å; D284-I288 WeakPolarHBondContact O-CB 3.43Å; D284-I288 VanDerWaalsContact O-CD1 3.32Å; D284-I288 WeakPolarHBondContact O-CD1 3.29Å; D284-I288 WeakPolarHBondContact O-CG1 3.43Å; D284-I288 PolarHBondContact O-N 2.65Å; D284-G464 WeakPolarHBondContact OD1-CA 3.41Å; D284-G464 PolarHBondContact OD1-N 3.23Å; D284-N466 HydrophobicContact CB-CB 4.32Å; D284-N466 VanDerWaalsContact OD2-CB 3.31Å; D284-N466 WeakPolarHBondContact OD2-CB 3.43Å; D284-N466 PolarHBondContact OD2-ND2 3.1Å; D284-G467 VanDerWaalsContact CG-N 3.31Å; D284-G467 WeakPolarHBondContact OD1-CA 3.49Å; D284-G467 PolarHBondContact OD1-N 2.97Å
285	I	98.7	Very high	98.3	Very high	105 Å²	105	30.1 Å²	30.1	54%	0.538	16%	0.155	S	C	.	.	H	α-helix	trans	-64.4	-54.6	-174.3	-60.2	172.2	0	0	0	111.2	D256 I260 T283 C287 I288 A289	D256-I285 HydrophobicContact CB-CB 4.11Å; D256-I285 HydrophobicContact CB-CG2 4.13Å; I260-I285 HydrophobicContact CD1-CG2 4.25Å; T283-I285 PolarHBondContact O-N 2.8Å; T283-I285 PolarHBondContact OG1-N 2.86Å; I285-C287 VanDerWaalsContact C-N 3.34Å; I285-I288 PolarHBondContact O-N 3.47Å; I285-A289 PolarHBondContact O-N 3.38Å; I285-A289 VanDerWaalsContact O-N 3.14Å
286	G	98.7	Very high	98.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-35.6	178.6	0	0	0	0	0	112.3	D256 T259 A289 L290	D256-G286 WeakPolarHBondContact OD1-CA 3.49Å; D256-G286 PolarHBondContact OD1-N 3.27Å; T259-G286 WeakPolarHBondContact CG2-O 3.16Å; G286-A289 WeakPolarHBondContact O-CB 3.28Å; G286-A289 PolarHBondContact O-N 2.94Å; G286-L290 PolarHBondContact O-N 3.36Å
287	C	98.7	Very high	98	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-47.2	174.8	-175.7	0	0	0	0	112.1	T283 D284 I285 A289 L290 A291 I463	T283-C287 WeakPolarHBondContact O-CB 3.46Å; T283-C287 PolarHBondContact O-N 2.84Å; D284-C287 PolarHBondContact O-N 3.31Å; I285-C287 VanDerWaalsContact C-N 3.34Å; C287-A289 VanDerWaalsContact C-N 3.26Å; C287-A289 PolarHBondContact O-N 3Å; C287-L290 PolarHBondContact O-N 3.03Å; C287-A291 WeakPolarHBondContact O-CB 3.49Å; C287-A291 PolarHBondContact O-N 2.75Å; C287-I463 HydrophobicContact CB-CD1 3.94Å; C287-I463 HydrophobicContact CB-CG1 3.99Å; C287-I463 HydrophobicContact CB-CG2 3.9Å
288	I	98.7	Very high	97.9	Very high	53 Å²	53	37 Å²	37	27%	0.272	19%	0.185	S	C	.	.	H	α-helix	trans	-60.7	-37.5	176.7	-71.6	163.6	0	0	0	110.9	D284 I285 A291 K292 A470	D284-I288 HydrophobicContact CB-CD1 4.35Å; D284-I288 VanDerWaalsContact O-CB 3.3Å; D284-I288 WeakPolarHBondContact O-CB 3.43Å; D284-I288 VanDerWaalsContact O-CD1 3.32Å; D284-I288 WeakPolarHBondContact O-CD1 3.29Å; D284-I288 WeakPolarHBondContact O-CG1 3.43Å; D284-I288 PolarHBondContact O-N 2.65Å; I285-I288 PolarHBondContact O-N 3.47Å; I288-A291 PolarHBondContact O-N 2.67Å; I288-K292 HydrophobicContact CG2-CD 4.27Å; I288-K292 HydrophobicContact CG2-CG 4.46Å; I288-K292 WeakPolarHBondContact O-CG 3.5Å; I288-K292 PolarHBondContact O-N 2.82Å; I288-A470 HydrophobicContact CB-CB 4.48Å; I288-A470 HydrophobicContact CG1-CB 3.73Å
289	A	98.6	Very high	97.7	Very high	19 Å²	19	36.9 Å²	36.9	16%	0.157	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-46.4	176.1	0	0	0	0	0	111.8	I260 A263 I285 G286 C287 V293	I260-A289 HydrophobicContact CG1-CB 3.84Å; A263-A289 HydrophobicContact CB-CB 4.02Å; I285-A289 PolarHBondContact O-N 3.38Å; I285-A289 VanDerWaalsContact O-N 3.14Å; G286-A289 WeakPolarHBondContact O-CB 3.28Å; G286-A289 PolarHBondContact O-N 2.94Å; C287-A289 VanDerWaalsContact C-N 3.26Å; C287-A289 PolarHBondContact O-N 3Å; A289-V293 WeakPolarHBondContact O-CG2 3.48Å; A289-V293 PolarHBondContact O-N 3.19Å
290	L	98.7	Very high	97.6	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-44.4	174.8	-71.9	171.1	0	0	0	112.2	T259 A263 L266 G286 C287 K292 V293 I294 L456 L458	T259-L290 HydrophobicContact CG2-CD1 3.57Å; T259-L290 HydrophobicContact CG2-CD2 4.46Å; T259-L290 HydrophobicContact CG2-CG 3.77Å; A263-L290 HydrophobicContact CB-CD2 4.1Å; L266-L290 HydrophobicContact CD1-CD2 3.93Å; G286-L290 PolarHBondContact O-N 3.36Å; C287-L290 PolarHBondContact O-N 3.03Å; L290-K292 VanDerWaalsContact C-N 3.32Å; L290-K292 PolarHBondContact O-N 2.89Å; L290-V293 PolarHBondContact O-N 2.98Å; L290-V293 VanDerWaalsContact O-N 3.09Å; L290-I294 WeakPolarHBondContact O-CG1 3.49Å; L290-I294 PolarHBondContact O-N 3.19Å; L290-I294 VanDerWaalsContact O-N 3.08Å; L290-L456 HydrophobicContact CD1-CD1 4.46Å; L290-L458 HydrophobicContact CD1-CD2 3.77Å
291	A	98.6	Very high	97.4	Very high	3 Å²	3	43.6 Å²	43.6	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-59.2	-41.4	-179.7	0	0	0	0	0	112.4	C287 I288 V293 I294 S295 A470 L471 A474	C287-A291 WeakPolarHBondContact O-CB 3.49Å; C287-A291 PolarHBondContact O-N 2.75Å; I288-A291 PolarHBondContact O-N 2.67Å; A291-V293 VanDerWaalsContact C-N 3.29Å; A291-V293 PolarHBondContact O-N 3.27Å; A291-I294 PolarHBondContact O-N 3.44Å; A291-S295 WeakPolarHBondContact O-CB 3.42Å; A291-S295 PolarHBondContact O-N 3.2Å; A291-A470 HydrophobicContact CB-CB 3.91Å; A291-L471 HydrophobicContact CB-CD2 4.31Å; A291-A474 HydrophobicContact CB-CB 4.2Å; A291-A474 WeakPolarHBondContact O-CB 3.22Å
292	K	97.8	Very high	97.2	Very high	129 Å²	129	44 Å²	44	56%	0.561	22%	0.221	S	C	*	.	H	α-helix	trans	-58.6	-40.4	174.7	-77.4	175.2	177.5	178.1	0	112.4	I288 L290 Q296	I288-K292 HydrophobicContact CG2-CD 4.27Å; I288-K292 HydrophobicContact CG2-CG 4.46Å; I288-K292 WeakPolarHBondContact O-CG 3.5Å; I288-K292 PolarHBondContact O-N 2.82Å; L290-K292 VanDerWaalsContact C-N 3.32Å; L290-K292 PolarHBondContact O-N 2.89Å; K292-Q296 CarbonylContact O-C 3.37Å
293	V	97	Very high	97	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.03	22%	0.224	C	C	.	.	H	α-helix	trans	-72.9	-33.4	-178.7	178.6	0	0	0	0	111.5	A263 L266 R267 A289 L290 A291 F297 G449 N450	A263-V293 HydrophobicContact CB-CG2 4.01Å; A263-V293 WeakPolarHBondContact O-CG2 3.5Å; L266-V293 HydrophobicContact CB-CG1 3.75Å; R267-V293 HydrophobicContact CG-CG1 4.28Å; R267-V293 HydrophobicContact CG-CG2 3.82Å; A289-V293 WeakPolarHBondContact O-CG2 3.48Å; A289-V293 PolarHBondContact O-N 3.19Å; L290-V293 PolarHBondContact O-N 2.98Å; L290-V293 VanDerWaalsContact O-N 3.09Å; A291-V293 VanDerWaalsContact C-N 3.29Å; A291-V293 PolarHBondContact O-N 3.27Å; V293-F297 HydrophobicContact CG1-CE1 4.29Å; V293-G449 CarbonylContact O-C 3.58Å; V293-G449 WeakPolarHBondContact O-CA 3.44Å; V293-N450 HydrophobicContact CG1-CB 4.09Å; V293-N450 PolarHBondContact O-N 3.28Å
294	I	96.3	Very high	96.8	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-75	-29	177.5	-67.6	165.1	0	0	0	111.7	L290 A291 L453 L456 A474 Q478 I495	L290-I294 WeakPolarHBondContact O-CG1 3.49Å; L290-I294 PolarHBondContact O-N 3.19Å; L290-I294 VanDerWaalsContact O-N 3.08Å; A291-I294 PolarHBondContact O-N 3.44Å; I294-L453 HydrophobicContact CD1-CD2 4.22Å; I294-L453 HydrophobicContact CG1-CD2 4.42Å; I294-L456 HydrophobicContact CD1-CD2 3.63Å; I294-A474 HydrophobicContact CG2-CB 4.44Å; I294-Q478 HydrophobicContact CG2-CG 4.38Å; I294-Q478 PolarHBondContact O-NE2 3.24Å; I294-I495 HydrophobicContact CD1-CD1 4.04Å; I294-I495 HydrophobicContact CD1-CG1 4.31Å; I294-I495 HydrophobicContact CG2-CD1 4.38Å; I294-I495 HydrophobicContact CG2-CG1 3.61Å
295	S	96.5	Very high	96.6	Very high	19 Å²	19	45.7 Å²	45.7	13%	0.133	23%	0.23	C	C	.	.	S	Bend	trans	-82.9	-111.4	178.6	-174.5	0	0	0	0	112	A291 G449 Y477	A291-S295 WeakPolarHBondContact O-CB 3.42Å; A291-S295 PolarHBondContact O-N 3.2Å; S295-G449 WeakPolarHBondContact O-CA 3.15Å; S295-G449 PolarHBondContact O-N 3.08Å; S295-Y477 VanDerWaalsContact O-CE1 3.24Å; S295-Y477 WeakPolarHBondContact O-CE1 3.46Å
296	Q	94.7	Very high	96.3	Very high	73 Å²	73	43 Å²	43	34%	0.341	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	151.6	169.6	53	177.5	-6.2	0	0	108.1	K292 L446 I447 Y477	K292-Q296 CarbonylContact O-C 3.37Å; Q296-L446 HydrophobicContact CB-CD1 4.05Å; Q296-L446 HydrophobicContact CB-CG 4.48Å; Q296-L446 HydrophobicContact CG-CD1 4.05Å; Q296-L446 VanDerWaalsContact OE1-CD2 3.31Å; Q296-I447 WeakPolarHBondContact CA-O 3.41Å; Q296-I447 VanDerWaalsContact CB-O 3.28Å; Q296-I447 WeakPolarHBondContact CB-O 3.29Å; Q296-Y477 HydrophobicContact CB-CE1 4Å; Q296-Y477 HydrophobicContact CB-CE2 4.3Å; Q296-Y477 HydrophobicContact CG-CD2 4.36Å; Q296-Y477 HydrophobicContact CG-CE1 4.31Å; Q296-Y477 HydrophobicContact CG-CE2 3.93Å
297	F	95.7	Very high	96	Very high	9 Å²	9	44.3 Å²	44.3	4%	0.039	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	150.3	-176.5	56.7	-104.3	0	0	0	112.4	R267 V293 L299 I447	R267-F297 HydrophobicContact CB-CE1 4.48Å; R267-F297 HydrophobicContact CB-CE2 4.32Å; R267-F297 HydrophobicContact CB-CZ 3.86Å; R267-F297 HydrophobicContact CG-CE1 4.31Å; R267-F297 HydrophobicContact CG-CE2 4.32Å; R267-F297 HydrophobicContact CG-CZ 4.03Å; R267-F297 VanDerWaalsContact NH1-CG 3.27Å; R267-F297 VanDerWaalsContact NH2-CE2 3.28Å; V293-F297 HydrophobicContact CG1-CE1 4.29Å; F297-L299 HydrophobicContact CE2-CD2 4.25Å; F297-I447 HydrophobicContact CD2-CD1 4.25Å; F297-I447 HydrophobicContact CD2-CG1 3.82Å; F297-I447 HydrophobicContact CE2-CD1 3.44Å; F297-I447 VanDerWaalsContact CE2-CD1 3.44Å; F297-I447 HydrophobicContact CE2-CG1 3.53Å; F297-I447 HydrophobicContact CZ-CD1 3.67Å; F297-I447 HydrophobicContact CZ-CG1 4Å; F297-I447 PolarHBondContact N-O 2.99Å; F297-I447 VanDerWaalsContact N-O 3.08Å; F297-I447 PolarHBondContact O-N 2.78Å
298	F	96.2	Very high	95.7	Very high	75 Å²	75	52.2 Å²	52.2	33%	0.329	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	139.1	170.6	-68.9	-75.3	0	0	0	110.2	R267 V440 Y443 L445 L446	R267-F298 PolarHBondContact NH2-O 3.09Å; F298-V440 HydrophobicContact CE1-CB 3.94Å; F298-V440 HydrophobicContact CE1-CG2 4.26Å; F298-V440 HydrophobicContact CZ-CB 4.2Å; F298-Y443 HydrophobicContact CE1-CG 4.32Å; F298-Y443 HydrophobicContact CE2-CG 4.08Å; F298-Y443 HydrophobicContact CZ-CD2 4.05Å; F298-Y443 AromaticContact CZ-CG 3.84Å; F298-Y443 HydrophobicContact CZ-CG 3.84Å; F298-L445 CarbonylContact C-O 3.58Å; F298-L445 WeakPolarHBondContact CA-O 3.34Å; F298-L446 HydrophobicContact CD1-CB 4Å; F298-L446 HydrophobicContact CD1-CD1 4.19Å; F298-L446 HydrophobicContact CD2-CD1 4.28Å; F298-L446 HydrophobicContact CE1-CB 3.71Å; F298-L446 HydrophobicContact CE1-CD1 4.06Å; F298-L446 HydrophobicContact CE1-CD2 4.49Å; F298-L446 HydrophobicContact CE1-CG 4.32Å; F298-L446 HydrophobicContact CE2-CD1 4.17Å; F298-L446 HydrophobicContact CG-CD1 4.29Å; F298-L446 HydrophobicContact CZ-CB 4.37Å; F298-L446 HydrophobicContact CZ-CD1 4.05Å; F298-L446 HydrophobicContact CZ-CD2 4.38Å
299	L	95.8	Very high	95.4	Very high	10 Å²	10	53.8 Å²	53.8	5%	0.052	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-66.9	137.2	169.3	-65.1	-177.5	0	0	0	109.9	F297 E303 I304 I433 L445 I447	F297-L299 HydrophobicContact CE2-CD2 4.25Å; L299-E303 VanDerWaalsContact CA-OE2 3.24Å; L299-E303 WeakPolarHBondContact CA-OE2 3.43Å; L299-E303 HydrophobicContact CB-CB 4.2Å; L299-E303 HydrophobicContact CD2-CB 4.18Å; L299-I304 HydrophobicContact CB-CD1 4.32Å; L299-I304 HydrophobicContact CB-CG1 3.72Å; L299-I304 HydrophobicContact CD1-CG1 4.41Å; L299-I433 HydrophobicContact CD1-CG2 4.39Å; L299-I433 HydrophobicContact CD2-CG2 4.19Å; L299-L445 HydrophobicContact CB-CB 4.42Å; L299-L445 HydrophobicContact CD1-CB 4.09Å; L299-L445 HydrophobicContact CD1-CD1 4.31Å; L299-L445 HydrophobicContact CG-CB 4.36Å; L299-L445 PolarHBondContact N-O 3.47Å; L299-I447 HydrophobicContact CD1-CG2 4.26Å; L299-I447 HydrophobicContact CD2-CD1 3.68Å; L299-I447 HydrophobicContact CD2-CG1 3.9Å; L299-I447 HydrophobicContact CD2-CG2 4.35Å; L299-I447 HydrophobicContact CG-CG1 4.42Å; L299-I447 HydrophobicContact CG-CG2 4.19Å
300	T	94.8	Very high	95	Very high	64 Å²	64	53.6 Å²	53.6	39%	0.393	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-71.3	164.6	172.1	71.5	0	0	0	0	110.2	E302 E303 I304	T300-E302 PolarHBondContact O-N 3.47Å; T300-E303 PolarHBondContact N-OE2 3.4Å; T300-E303 PolarHBondContact O-N 3.3Å; T300-E303 WeakPolarHBondContact OG1-CG 3.23Å; T300-E303 PolarHBondContact OG1-N 3.04Å; T300-E303 PolarHBondContact OG1-OE2 2.73Å; T300-I304 VanDerWaalsContact O-CG1 3.29Å; T300-I304 WeakPolarHBondContact O-CG1 3.38Å; T300-I304 PolarHBondContact O-N 3.15Å
301	H	94.6	Very high	94.5	Very high	143 Å²	143	57.8 Å²	57.8	66%	0.662	27%	0.274	S	S	*	.	H	α-helix	trans	-55.2	-43.1	174.8	-179.6	71.3	0	0	0	111.8	E303 I304 V305	H301-E303 PolarHBondContact O-N 3.18Å; H301-I304 PolarHBondContact O-N 3.28Å; H301-V305 WeakPolarHBondContact O-CG2 3.43Å; H301-V305 PolarHBondContact O-N 3.44Å
302	E	94.4	Very high	94.1	Very high	134 Å²	134	59.8 Å²	59.8	63%	0.626	29%	0.287	S	S	*	.	H	α-helix	trans	-62.3	-42.4	179.3	-59.2	-173.3	167.2	0	0	112.1	M237 T300 V305 Y306	M237-E302 HydrophobicContact CE-CB 4.07Å; T300-E302 PolarHBondContact O-N 3.47Å; E302-V305 PolarHBondContact O-N 3.16Å; E302-Y306 WeakPolarHBondContact O-CB 3.39Å; E302-Y306 PolarHBondContact O-N 3.44Å
303	E	95.1	Very high	93.6	Very high	13 Å²	13	58.6 Å²	58.6	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-68.3	-35.4	176.9	-69	168.9	155.1	0	0	112.4	M237 R267 L299 T300 H301 Y306 R307 I433	M237-E303 HydrophobicContact CG-CG 4.32Å; M237-E303 HydrophobicContact SD-CB 4.23Å; M237-E303 HydrophobicContact SD-CG 3.67Å; R267-E303 IonicContact CZ-OE1 3.4Å; R267-E303 IonicContact CZ-OE2 3.56Å; R267-E303 IonicContact NE-OE1 2.72Å; R267-E303 PolarHBondContact NE-OE1 3.38Å; R267-E303 IonicContact NE-OE2 3.68Å; R267-E303 VanDerWaalsContact NH2-CD 3.34Å; R267-E303 IonicContact NH2-OE1 3.24Å; R267-E303 PolarHBondContact NH2-OE1 3.12Å; R267-E303 IonicContact NH2-OE2 2.64Å; R267-E303 PolarHBondContact NH2-OE2 2.85Å; L299-E303 VanDerWaalsContact CA-OE2 3.24Å; L299-E303 WeakPolarHBondContact CA-OE2 3.43Å; L299-E303 HydrophobicContact CB-CB 4.2Å; L299-E303 HydrophobicContact CD2-CB 4.18Å; T300-E303 PolarHBondContact N-OE2 3.4Å; T300-E303 PolarHBondContact O-N 3.3Å; T300-E303 WeakPolarHBondContact OG1-CG 3.23Å; T300-E303 PolarHBondContact OG1-N 3.04Å; T300-E303 PolarHBondContact OG1-OE2 2.73Å; H301-E303 PolarHBondContact O-N 3.18Å; E303-Y306 PolarHBondContact O-N 3.12Å; E303-R307 VanDerWaalsContact O-CB 3.23Å; E303-R307 WeakPolarHBondContact O-CB 3.15Å; E303-R307 PolarHBondContact O-N 3.07Å; E303-I433 HydrophobicContact CB-CD1 4.49Å; E303-I433 HydrophobicContact CB-CG2 4.09Å; E303-I433 HydrophobicContact CG-CD1 4Å
304	I	94	Very high	92.9	Very high	28 Å²	28	63.8 Å²	63.8	14%	0.144	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-43	174.2	-66.6	169.1	0	0	0	110.2	L299 T300 H301 R307 R308 L445	L299-I304 HydrophobicContact CB-CD1 4.32Å; L299-I304 HydrophobicContact CB-CG1 3.72Å; L299-I304 HydrophobicContact CD1-CG1 4.41Å; T300-I304 VanDerWaalsContact O-CG1 3.29Å; T300-I304 WeakPolarHBondContact O-CG1 3.38Å; T300-I304 PolarHBondContact O-N 3.15Å; H301-I304 PolarHBondContact O-N 3.28Å; I304-R307 PolarHBondContact O-N 3.02Å; I304-R308 VanDerWaalsContact O-CG 3.32Å; I304-R308 WeakPolarHBondContact O-CG 3.21Å; I304-R308 PolarHBondContact O-N 3.29Å; I304-L445 HydrophobicContact CG1-CD1 4.33Å
305	V	94.3	Very high	92	Very high	72 Å²	72	67 Å²	67	44%	0.436	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-47.7	175.8	171.1	0	0	0	0	110.2	H301 E302 R307 R308 L309	H301-V305 WeakPolarHBondContact O-CG2 3.43Å; H301-V305 PolarHBondContact O-N 3.44Å; E302-V305 PolarHBondContact O-N 3.16Å; V305-R307 PolarHBondContact O-N 3.44Å; V305-R308 PolarHBondContact O-N 2.99Å; V305-L309 PolarHBondContact O-N 2.87Å
306	Y	92.7	Very high	91.3	Very high	48 Å²	48	72.9 Å²	72.9	19%	0.188	35%	0.352	C	S	.	.	H	α-helix	trans	-60.7	-45.4	177.2	-179.9	-96	0	0	0	112.2	M237 Q238 E302 E303 R308 L309 C310 N431	M237-Y306 HydrophobicContact CB-CD1 4.09Å; M237-Y306 HydrophobicContact CB-CD2 4.21Å; M237-Y306 HydrophobicContact CB-CE1 4.27Å; M237-Y306 HydrophobicContact CB-CE2 4.37Å; M237-Y306 HydrophobicContact CB-CG 4.07Å; M237-Y306 WeakPolarHBondContact O-CE1 3.48Å; M237-Y306 PolarHBondContact O-OH 3.03Å; M237-Y306 VanDerWaalsContact O-OH 3.07Å; M237-Y306 HydrophobicContact SD-CD1 4.49Å; M237-Y306 HydrophobicContact SD-CG 4.1Å; Q238-Y306 HydrophobicContact CG-CE2 4.15Å; E302-Y306 WeakPolarHBondContact O-CB 3.39Å; E302-Y306 PolarHBondContact O-N 3.44Å; E303-Y306 PolarHBondContact O-N 3.12Å; Y306-R308 VanDerWaalsContact C-N 3.31Å; Y306-R308 PolarHBondContact O-N 3.18Å; Y306-L309 WeakPolarHBondContact O-CB 3.24Å; Y306-L309 PolarHBondContact O-N 2.76Å; Y306-L309 VanDerWaalsContact O-N 3.12Å; Y306-C310 WeakPolarHBondContact CE1-SG 3.3Å; Y306-C310 PolarHBondContact O-N 3.05Å; Y306-C310 PolarHBondContact O-SG 2.83Å; Y306-N431 VanDerWaalsContact CE1-ND2 3.28Å; Y306-N431 WeakPolarHBondContact CE1-ND2 3.38Å
307	R	93	Very high	90.3	Very high	28 Å²	28	73.2 Å²	73.2	11%	0.106	36%	0.362	C	S	.	.	H	α-helix	trans	-54	-47.3	174.6	178.1	176.8	-177	123.6	0.5	111.7	E303 I304 V305 C310 Q311 I433 L434 D435	E303-R307 VanDerWaalsContact O-CB 3.23Å; E303-R307 WeakPolarHBondContact O-CB 3.15Å; E303-R307 PolarHBondContact O-N 3.07Å; I304-R307 PolarHBondContact O-N 3.02Å; V305-R307 PolarHBondContact O-N 3.44Å; R307-C310 PolarHBondContact O-N 3.18Å; R307-Q311 VanDerWaalsContact O-CG 3.27Å; R307-Q311 WeakPolarHBondContact O-CG 3.45Å; R307-Q311 PolarHBondContact O-N 3.02Å; R307-I433 HydrophobicContact CB-CG2 4.13Å; R307-I433 PolarHBondContact NH1-O 3.43Å; R307-L434 HydrophobicContact CB-CD2 4.16Å; R307-L434 HydrophobicContact CG-CD2 3.86Å; R307-D435 VanDerWaalsContact CZ-O 3.28Å; R307-D435 PolarHBondContact NH1-O 2.91Å; R307-D435 PolarHBondContact NH2-O 3.44Å
308	R	93.1	Very high	89.2	Confident	165 Å²	165	80.5 Å²	80.5	62%	0.623	40%	0.396	S	S	*	.	H	α-helix	trans	-64.7	-39.9	178.2	-71.8	172.9	-176.2	176.4	2	111.8	I304 V305 Y306 Q311 S312	I304-R308 VanDerWaalsContact O-CG 3.32Å; I304-R308 WeakPolarHBondContact O-CG 3.21Å; I304-R308 PolarHBondContact O-N 3.29Å; V305-R308 PolarHBondContact O-N 2.99Å; Y306-R308 VanDerWaalsContact C-N 3.31Å; Y306-R308 PolarHBondContact O-N 3.18Å; R308-Q311 PolarHBondContact O-N 3.21Å; R308-S312 WeakPolarHBondContact O-CB 3.41Å; R308-S312 PolarHBondContact O-N 3.2Å
309	L	92	Very high	87.6	Confident	86 Å²	86	80.9 Å²	80.9	45%	0.45	41%	0.409	S	S	.	.	H	α-helix	trans	-59.1	-52.9	176.1	-177.6	64.9	0	0	0	110.6	V305 Y306 Q311 S312 E313	V305-L309 PolarHBondContact O-N 2.87Å; Y306-L309 WeakPolarHBondContact O-CB 3.24Å; Y306-L309 PolarHBondContact O-N 2.76Å; Y306-L309 VanDerWaalsContact O-N 3.12Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 2.74Å; L309-S312 WeakPolarHBondContact O-CB 3.27Å; L309-S312 PolarHBondContact O-N 2.93Å; L309-S312 PolarHBondContact O-OG 3.49Å; L309-E313 WeakPolarHBondContact O-CG 3.29Å; L309-E313 PolarHBondContact O-N 2.82Å
310	C	89.8	Confident	85.6	Confident	15 Å²	15	86.4 Å²	86.4	10%	0.101	44%	0.437	C	S	.	.	H	α-helix	trans	-59.4	-40	178.5	-64.8	0	0	0	0	112.9	Y306 R307 S312 E313 K314 L434	Y306-C310 WeakPolarHBondContact CE1-SG 3.3Å; Y306-C310 PolarHBondContact O-N 3.05Å; Y306-C310 PolarHBondContact O-SG 2.83Å; R307-C310 PolarHBondContact O-N 3.18Å; C310-S312 VanDerWaalsContact C-N 3.34Å; C310-E313 PolarHBondContact O-N 3.05Å; C310-K314 WeakPolarHBondContact O-CG 3.44Å; C310-K314 PolarHBondContact O-N 2.78Å; C310-K314 VanDerWaalsContact O-N 3.16Å; C310-L434 HydrophobicContact CB-CD1 4.18Å; C310-L434 HydrophobicContact CB-CD2 3.96Å
311	Q	88.4	Confident	83.2	Confident	90 Å²	90	87.9 Å²	87.9	42%	0.421	45%	0.447	S	S	.	.	H	α-helix	trans	-66.1	-37.2	176.1	-72	174.5	-17.1	0	0	112	R307 R308 L309 S315	R307-Q311 VanDerWaalsContact O-CG 3.27Å; R307-Q311 WeakPolarHBondContact O-CG 3.45Å; R307-Q311 PolarHBondContact O-N 3.02Å; R308-Q311 PolarHBondContact O-N 3.21Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 2.74Å; Q311-S315 PolarHBondContact O-N 3.46Å; Q311-S315 VanDerWaalsContact O-N 3.15Å; Q311-S315 PolarHBondContact O-OG 3.11Å
312	S	89.7	Confident	80.9	Confident	45 Å²	45	89.7 Å²	89.7	32%	0.315	46%	0.461	S	S	.	.	H	α-helix	trans	-68.5	-35.4	176.8	80.8	0	0	0	0	112.6	R308 L309 C310 S315 K316	R308-S312 WeakPolarHBondContact O-CB 3.41Å; R308-S312 PolarHBondContact O-N 3.2Å; L309-S312 WeakPolarHBondContact O-CB 3.27Å; L309-S312 PolarHBondContact O-N 2.93Å; L309-S312 PolarHBondContact O-OG 3.49Å; C310-S312 VanDerWaalsContact C-N 3.34Å; S312-S315 PolarHBondContact O-N 3.45Å; S312-K316 WeakPolarHBondContact O-CG 3.46Å; S312-K316 PolarHBondContact O-N 3.16Å; S312-K316 VanDerWaalsContact O-N 3.12Å
313	E	87.4	Confident	78.4	Confident	104 Å²	104	88.7 Å²	88.7	49%	0.486	46%	0.464	S	S	.	.	H	α-helix	trans	-68.2	-43.4	177	-71.7	173.1	168.4	0	0	111.4	L309 C310 S315 K316 S317	L309-E313 WeakPolarHBondContact O-CG 3.29Å; L309-E313 PolarHBondContact O-N 2.82Å; C310-E313 PolarHBondContact O-N 3.05Å; E313-S315 VanDerWaalsContact C-N 3.3Å; E313-S315 PolarHBondContact O-N 3.28Å; E313-K316 WeakPolarHBondContact O-CB 3.4Å; E313-K316 PolarHBondContact O-N 3.31Å; E313-K316 VanDerWaalsContact O-N 3.12Å; E313-S317 PolarHBondContact O-N 3.43Å; E313-S317 PolarHBondContact O-OG 3.02Å
314	K	82.5	Confident	75.8	Confident	113 Å²	113	93.4 Å²	93.4	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-58.3	-42.5	173.4	-71.5	-178.7	179.9	-169.5	0	112.2	C310 K316 S317 E318	C310-K314 WeakPolarHBondContact O-CG 3.44Å; C310-K314 PolarHBondContact O-N 2.78Å; C310-K314 VanDerWaalsContact O-N 3.16Å; K314-K316 VanDerWaalsContact C-N 3.29Å; K314-K316 PolarHBondContact O-N 3.45Å; K314-S317 WeakPolarHBondContact CA-OG 3.5Å; K314-S317 PolarHBondContact O-N 3.34Å; K314-S317 PolarHBondContact O-OG 2.97Å; K314-E318 WeakPolarHBondContact O-CG 3.39Å; K314-E318 PolarHBondContact O-N 3.46Å; K314-E318 VanDerWaalsContact O-N 3.07Å
315	S	78.3	Confident	73.2	Confident	73 Å²	73	97.4 Å²	97.4	51%	0.51	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-32.7	177.6	-53.7	0	0	0	0	112.5	Q311 S312 E313 S319	Q311-S315 PolarHBondContact O-N 3.46Å; Q311-S315 VanDerWaalsContact O-N 3.15Å; Q311-S315 PolarHBondContact O-OG 3.11Å; S312-S315 PolarHBondContact O-N 3.45Å; E313-S315 VanDerWaalsContact C-N 3.3Å; E313-S315 PolarHBondContact O-N 3.28Å; S315-S319 WeakPolarHBondContact O-CB 3.43Å; S315-S319 PolarHBondContact O-N 2.94Å; S315-S319 PolarHBondContact O-OG 3.06Å
316	K	81.1	Confident	70.7	Confident	143 Å²	143	100.1 Å²	100.1	62%	0.622	55%	0.548	S	S	*	.	H	α-helix	trans	-73.3	-38.7	175.7	-73.7	173.3	-176.7	173.9	0	112.5	S312 E313 K314 E318 S319	S312-K316 WeakPolarHBondContact O-CG 3.46Å; S312-K316 PolarHBondContact O-N 3.16Å; S312-K316 VanDerWaalsContact O-N 3.12Å; E313-K316 WeakPolarHBondContact O-CB 3.4Å; E313-K316 PolarHBondContact O-N 3.31Å; E313-K316 VanDerWaalsContact O-N 3.12Å; K314-K316 VanDerWaalsContact C-N 3.29Å; K314-K316 PolarHBondContact O-N 3.45Å; K316-E318 VanDerWaalsContact C-N 3.33Å; K316-S319 WeakPolarHBondContact CA-OG 3.22Å; K316-S319 PolarHBondContact O-N 3.22Å; K316-S319 PolarHBondContact O-OG 3.34Å
317	S	74.2	Confident	68.4	Low	79 Å²	79	106.1 Å²	106.1	55%	0.552	58%	0.583	S	S	*	*	H	α-helix	trans	-67.7	-33.1	175.6	46.3	0	0	0	0	112.6	E313 K314	E313-S317 PolarHBondContact O-N 3.43Å; E313-S317 PolarHBondContact O-OG 3.02Å; K314-S317 WeakPolarHBondContact CA-OG 3.5Å; K314-S317 PolarHBondContact O-N 3.34Å; K314-S317 PolarHBondContact O-OG 2.97Å
318	E	71.4	Confident	65.9	Low	162 Å²	162	108.3 Å²	108.3	76%	0.757	61%	0.614	S	S	*	*	H	α-helix	trans	-78.5	-20.1	178.7	-72.3	175.4	-172	0	0	113.6	K314 K316	K314-E318 WeakPolarHBondContact O-CG 3.39Å; K314-E318 PolarHBondContact O-N 3.46Å; K314-E318 VanDerWaalsContact O-N 3.07Å; K316-E318 VanDerWaalsContact C-N 3.33Å
319	S	63.6	Low	63.4	Low	84 Å²	84	112.6 Å²	112.6	59%	0.587	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	5.2	-177	45.8	0	0	0	0	114.9	S315 K316 P321	S315-S319 WeakPolarHBondContact O-CB 3.43Å; S315-S319 PolarHBondContact O-N 2.94Å; S315-S319 PolarHBondContact O-OG 3.06Å; K316-S319 WeakPolarHBondContact CA-OG 3.22Å; K316-S319 PolarHBondContact O-N 3.22Å; K316-S319 PolarHBondContact O-OG 3.34Å; S319-P321 VanDerWaalsContact O-CD 3.25Å; S319-P321 WeakPolarHBondContact O-CD 3.48Å
320	I	53.8	Low	60.9	Low	126 Å²	126	120.1 Å²	120.1	65%	0.646	65%	0.653	S	S	*	*	S	Bend	trans	-81.1	111.9	171.7	-54	171.3	0	0	0	108.5	L322	I320-L322 PolarHBondContact O-N 3.46Å
321	P	43.6	Very low	58.3	Low	94 Å²	94	129.3 Å²	129.3	61%	0.61	69%	0.691	S	S	*	*			trans	-70.5	123.4	175.9	-8.9	25.8	0	0	0	109.1	S319 T323	S319-P321 VanDerWaalsContact O-CD 3.25Å; S319-P321 WeakPolarHBondContact O-CD 3.48Å; P321-T323 HydrophobicContact CB-CG2 4.24Å; P321-T323 PolarHBondContact O-N 3.17Å
322	L	47.1	Very low	56.2	Low	181 Å²	181	130.3 Å²	130.3	95%	0.948	71%	0.708	S	S	*	*			trans	-68.9	73.9	162.4	-73	166.7	0	0	0	109	I320	I320-L322 PolarHBondContact O-N 3.46Å
323	T	42.1	Very low	53.8	Low	113 Å²	113	137.8 Å²	137.8	69%	0.693	74%	0.735	S	S	*	*			trans	-139.5	88.6	174.3	66.4	0	0	0	0	110.8	P321	P321-T323 HydrophobicContact CB-CG2 4.24Å; P321-T323 PolarHBondContact O-N 3.17Å
324	S	40.3	Very low	51.6	Low	112 Å²	112	140 Å²	140	78%	0.783	76%	0.755	S	S	*	*			trans	-172.4	92.6	140	45.7	0	0	0	0	110.3
325	S	38.1	Very low	49.7	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	77%	0.767	S	S	*	*			trans	-152.4	96.3	151.1	-65.9	0	0	0	0	106.1	L327	S325-L327 PolarHBondContact O-N 3.13Å
326	P	43.2	Very low	48.3	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	78%	0.778	S	S	*	*			trans	-65.8	134	-179.3	-18	30.7	0	0	0	110.9
327	L	43.7	Very low	46.2	Very low	174 Å²	174	140.2 Å²	140.2	91%	0.911	79%	0.786	S	S	*	*			trans	-59.3	140.3	174.3	-68.5	97.6	0	0	0	112.4	S325	S325-L327 PolarHBondContact O-N 3.13Å
328	G	40.4	Very low	44.8	Very low	74 Å²	74	140.1 Å²	140.1	76%	0.763	79%	0.79	S	S	*	*			trans	98.2	110.2	131.1	0	0	0	0	0	117.4
329	R	40.2	Very low	43.4	Very low	255 Å²	255	143.6 Å²	143.6	96%	0.962	80%	0.796	S	S	*	*				-161.4	139.5	116.9	-132.5	168.2	177.7	174.3	-2.2	113
330	R	39.4	Very low	42.3	Very low	244 Å²	244	146.2 Å²	146.2	92%	0.921	80%	0.804	S	S	*	*			trans	-63.2	153.8	-179.3	-83.6	169	149.7	173.8	-8	113.7
331	K	35.9	Very low	41.8	Very low	207 Å²	207	144.1 Å²	144.1	90%	0.9	81%	0.805	S	S	*	*			trans	-56.2	143.3	173.4	-60	177.3	174.9	179.4	0	114.6
332	S	43.3	Very low	41.7	Very low	112 Å²	112	144 Å²	144	78%	0.783	81%	0.807	S	S	*	*			trans	-167.3	102.1	136.1	53.7	0	0	0	0	110.6
333	K	40.8	Very low	41.5	Very low	202 Å²	202	144.2 Å²	144.2	88%	0.878	80%	0.8	S	S	*	*				37.4	111.8	120.2	-75.7	-175.5	175.4	179.7	0	115.6
334	V	40.7	Very low	41.2	Very low	149 Å²	149	147.7 Å²	147.7	90%	0.903	81%	0.808	S	S	*	*				-158.6	138.5	119.2	178	0	0	0	0	107.4
335	S	43.6	Very low	41.2	Very low	106 Å²	106	147.4 Å²	147.4	74%	0.741	81%	0.807	S	S	*	*			trans	-102.1	-163.6	-169.5	50.7	0	0	0	0	111.9
336	P	46.8	Very low	41.2	Very low	114 Å²	114	147.8 Å²	147.8	74%	0.74	80%	0.804	S	S	*	*				-130.1	172.6	-95.2	38.1	-19.6	0	0	0	113.4
337	S	38.9	Very low	41	Very low	115 Å²	115	151 Å²	151	80%	0.804	81%	0.808	S	S	*	*			trans	178.5	131.6	139	61.1	0	0	0	0	114.7
338	A	44.1	Very low	40.7	Very low	76 Å²	76	146.6 Å²	146.6	63%	0.628	80%	0.804	S	S	*	*				86.3	118.9	129.3	0	0	0	0	0	122.1
339	R	40.8	Very low	40.5	Very low	235 Å²	235	149.9 Å²	149.9	89%	0.887	81%	0.809	S	S	*	*			trans	76.6	143.2	136.9	-62.7	168.1	-170.3	-178.4	1.4	116
340	D	41.9	Very low	40.5	Very low	140 Å²	140	143.5 Å²	143.5	75%	0.749	80%	0.804	S	S	*	*			cis	-167.3	161.9	6.9	-135.2	-36	0	0	0	108.7
341	A	42.2	Very low	40.4	Very low	82 Å²	82	135.3 Å²	135.3	68%	0.678	80%	0.795	S	S	*	*			trans	26.8	149.6	143	0	0	0	0	0	121.8
342	S	42.3	Very low	40.5	Very low	92 Å²	92	130 Å²	130	64%	0.643	79%	0.79	S	S	*	*			cis	170	169	2	51.2	0	0	0	0	108.2
343	K	42.3	Very low	40.2	Very low	185 Å²	185	134.5 Å²	134.5	80%	0.804	80%	0.795	S	S	*	*			trans	85.6	113.4	159.1	-60.4	176.2	-179.4	-178.4	0	118.2
344	E	36.8	Very low	40.2	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.864	79%	0.792	S	S	*	*				60.3	115.4	74.1	-84.2	-172.9	155.9	0	0	115.2
345	S	39.5	Very low	40.1	Very low	107 Å²	107	137.1 Å²	137.1	75%	0.748	79%	0.788	S	S	*	*				156.1	116.8	116.8	67.5	0	0	0	0	113.8
346	T	38.8	Very low	39.8	Very low	121 Å²	121	139.5 Å²	139.5	74%	0.742	79%	0.793	S	S	*	*			trans	30.2	136.9	133.1	52.4	0	0	0	0	124.4
347	Q	38.5	Very low	39.6	Very low	197 Å²	197	144.4 Å²	144.4	92%	0.921	80%	0.803	S	S	*	*			trans	67.8	130.1	137.1	-72.2	-177.4	-9.9	0	0	120.8
348	G	36.6	Very low	39.5	Very low	80 Å²	80	144 Å²	144	83%	0.825	80%	0.8	S	S	*	*			trans	171.8	115.6	162.3	0	0	0	0	0	114
349	V	36.9	Very low	39.4	Very low	143 Å²	143	147.3 Å²	147.3	87%	0.867	81%	0.812	S	S	*	*			trans	-84.2	166.8	-174.9	170.9	0	0	0	0	112.1
350	S	40.2	Very low	39.2	Very low	122 Å²	122	147.6 Å²	147.6	85%	0.853	81%	0.813	S	S	*	*			trans	92.6	141.8	165.5	80.8	0	0	0	0	115.1
351	G	36.7	Very low	38.9	Very low	71 Å²	71	144.1 Å²	144.1	73%	0.732	81%	0.81	S	S	*	*			cis	163.3	162.2	5.6	0	0	0	0	0	108.1
352	A	39.3	Very low	38.8	Very low	97 Å²	97	152.2 Å²	152.2	80%	0.802	82%	0.823	S	S	*	*			trans	85.9	103.7	159.8	0	0	0	0	0	121.4
353	K	35.6	Very low	38.3	Very low	205 Å²	205	156 Å²	156	89%	0.891	84%	0.836	S	S	*	*				53.8	117	117.4	-73.3	179.3	175	174.2	0	120.8
354	K	41.8	Very low	38.2	Very low	184 Å²	184	151.5 Å²	151.5	80%	0.8	83%	0.834	S	S	*	*			trans	178.2	144.9	136.6	-103.5	171.9	179.9	172.7	0	107.5
355	R	39.4	Very low	38.2	Very low	222 Å²	222	151.5 Å²	151.5	84%	0.838	83%	0.831	S	S	*	*			cis	-172.2	147.1	-9	-123.7	179.3	-176.1	175.8	-2.4	105
356	D	36.7	Very low	38.1	Very low	156 Å²	156	152.8 Å²	152.8	83%	0.834	83%	0.83	S	S	*	*			trans	-55.3	155.4	179.5	-62.3	-70	0	0	0	116.3
357	K	42.6	Very low	38.2	Very low	217 Å²	217	155 Å²	155	94%	0.943	84%	0.835	S	S	*	*			trans	-158.6	134.2	132.1	-108.2	172	-172.9	-179.1	0	112.3
358	S	36.3	Very low	38	Very low	108 Å²	108	152.4 Å²	152.4	76%	0.755	83%	0.828	S	S	*	*			trans	-109.7	149.1	-168	47.5	0	0	0	0	112
359	V	41.9	Very low	38.2	Very low	144 Å²	144	153.6 Å²	153.6	87%	0.873	82%	0.823	S	S	*	*			trans	-156	96.1	154.4	-178.5	0	0	0	0	107.9
360	R	37.7	Very low	38.2	Very low	241 Å²	241	151.1 Å²	151.1	91%	0.909	81%	0.812	S	S	*	*				34	114.9	104.5	-92.5	178.5	170.1	164.6	-2.9	113.7
361	G	35	Very low	38.1	Very low	67 Å²	67	154.3 Å²	154.3	69%	0.691	81%	0.811	S	S	*	*			cis	98.1	116.5	41.5	0	0	0	0	0	110.1
362	R	39.2	Very low	38.2	Very low	253 Å²	253	157.7 Å²	157.7	96%	0.955	81%	0.812	S	S	*	*			trans	178.6	115	147.1	-97.5	163.2	-158	-177	5.7	112.2
363	N	32.3	Very low	38.3	Very low	170 Å²	170	161.2 Å²	161.2	91%	0.909	82%	0.817	S	S	*	*			trans	-87.8	149.1	158.6	-78.8	-18.1	0	0	0	109.8
364	A	39.7	Very low	38.2	Very low	92 Å²	92	160.9 Å²	160.9	76%	0.76	82%	0.816	S	S	*	*			trans	179.8	110.9	148.3	0	0	0	0	0	107.9
365	K	38.3	Very low	38.2	Very low	184 Å²	184	158.1 Å²	158.1	80%	0.8	82%	0.82	S	S	*	*				83.1	114.3	90.7	-84.3	-169.8	172.9	-177.7	0	114.2
366	D	36.4	Very low	38	Very low	135 Å²	135	151.5 Å²	151.5	72%	0.722	82%	0.821	S	S	*	*			trans	43.6	127.4	131.2	-45.7	-35.3	0	0	0	119.3
367	I	40.6	Very low	37.9	Very low	168 Å²	168	148 Å²	148	86%	0.862	82%	0.822	S	S	*	*				-177.2	129.6	116.2	-89	152.8	0	0	0	110.5
368	D	35.8	Very low	37.5	Very low	142 Å²	142	148.3 Å²	148.3	76%	0.759	82%	0.823	S	S	*	*			trans	-61.4	146.9	169	177.2	26.3	0	0	0	113.2
369	S	39.4	Very low	37.5	Very low	105 Å²	105	146.6 Å²	146.6	73%	0.734	82%	0.823	S	S	*	*				162.5	127.7	128.9	50.1	0	0	0	0	114.2
370	S	37	Very low	37.4	Very low	90 Å²	90	149.9 Å²	149.9	63%	0.629	83%	0.825	S	S	*	*			trans	-41.1	147.5	159.3	56.3	0	0	0	0	116.6
371	K	39.5	Very low	37.1	Very low	190 Å²	190	147.8 Å²	147.8	83%	0.826	82%	0.822	S	S	*	*				170.7	152.1	110.3	-94.9	171.7	-177.3	172.9	0	113.4
372	D	38.1	Very low	37.3	Very low	142 Å²	142	150.4 Å²	150.4	76%	0.759	83%	0.83	S	S	*	*			trans	-51	154.9	-179.7	-51.3	-80.3	0	0	0	115.6
373	D	40.5	Very low	37.1	Very low	170 Å²	170	145.4 Å²	145.4	91%	0.909	82%	0.823	S	S	*	*				-165.1	138.4	126.1	-99	-32.4	0	0	0	114.5
374	K	34.8	Very low	37.4	Very low	199 Å²	199	143.2 Å²	143.2	87%	0.865	82%	0.82	S	S	*	*			trans	-85	142.2	175	-79.6	170.9	172.4	166.5	0	111.2
375	S	42	Very low	37.3	Very low	126 Å²	126	144 Å²	144	88%	0.881	82%	0.82	S	S	*	*			trans	170.9	137.5	140.5	45	0	0	0	0	107.6
376	G	33.4	Very low	37.3	Very low	83 Å²	83	143 Å²	143	86%	0.856	82%	0.824	S	S	*	*			cis	105.4	85.7	30.1	0	0	0	0	0	109
377	G	36.4	Very low	37.2	Very low	83 Å²	83	141.7 Å²	141.7	86%	0.856	83%	0.825	S	S	*	*			trans	-167.3	113	178.2	0	0	0	0	0	114.5
378	K	33.9	Very low	37.2	Very low	222 Å²	222	140 Å²	140	97%	0.965	83%	0.825	S	S	*	*			trans	-82.6	150.1	-178.8	-68.5	171.2	173.3	172.1	0	112.7
379	G	36.6	Very low	37.1	Very low	73 Å²	73	142.9 Å²	142.9	75%	0.753	83%	0.831	S	S	*	*			trans	-179.9	92.9	157.6	0	0	0	0	0	111.7
380	K	38.3	Very low	36.9	Very low	212 Å²	212	147.6 Å²	147.6	92%	0.922	84%	0.838	S	S	*	*				73.9	102.4	100.3	-88.9	-172.6	177.5	178.5	0	116.5
381	K	32	Very low	36.7	Very low	197 Å²	197	147.7 Å²	147.7	86%	0.857	84%	0.844	S	S	*	*			trans	12	133.3	141.2	-69	-178.3	172.9	-175.9	0	119.9
382	S	39.9	Very low	36.5	Very low	122 Å²	122	147 Å²	147	85%	0.853	85%	0.849	S	S	*	*				-154.6	135.4	124.7	53.5	0	0	0	0	111.3
383	D	33.8	Very low	36.4	Very low	149 Å²	149	148.4 Å²	148.4	80%	0.797	85%	0.852	S	S	*	*			trans	-78.9	149.9	178.9	-61.8	-58.5	0	0	0	111.5
384	S	40.1	Very low	36.2	Very low	123 Å²	123	149.7 Å²	149.7	86%	0.86	85%	0.852	S	S	*	*			trans	-170.1	129.6	134	43.3	0	0	0	0	112.1
385	S	37.7	Very low	36.3	Very low	108 Å²	108	147.8 Å²	147.8	76%	0.755	85%	0.846	S	S	*	*			trans	-79.9	145.4	174.9	41.7	0	0	0	0	111.8
386	N	37.8	Very low	36.1	Very low	164 Å²	164	149.9 Å²	149.9	88%	0.877	85%	0.848	S	S	*	*			trans	-167.5	124.7	137.4	-110.3	-15.5	0	0	0	112.6
387	S	34.6	Very low	36.1	Very low	108 Å²	108	157.3 Å²	157.3	76%	0.755	85%	0.85	S	S	*	*			trans	-95.9	158.5	160.4	-32.8	0	0	0	0	108
388	P	40.1	Very low	36.4	Very low	132 Å²	132	159.3 Å²	159.3	86%	0.857	85%	0.851	S	S	*	*				-154.3	172.6	88.8	36.3	-15	0	0	0	117
389	K	32.8	Very low	36.4	Very low	203 Å²	203	154.8 Å²	154.8	88%	0.883	85%	0.847	S	S	*	*			trans	-68.6	149.9	-179.7	-62.4	168.7	174.2	175.4	0	115.2
390	K	36.3	Very low	36.4	Very low	203 Å²	203	155.1 Å²	155.1	88%	0.883	85%	0.85	S	S	*	*			trans	-178.8	109.4	139.3	-102.6	172.3	-179.6	-178.6	0	108.5
391	A	32.7	Very low	36.4	Very low	92 Å²	92	154.7 Å²	154.7	76%	0.76	85%	0.849	S	S	*	*				65.7	109	89.1	0	0	0	0	0	114.7
392	N	35.2	Very low	36.3	Very low	175 Å²	175	150.3 Å²	150.3	94%	0.936	84%	0.843	S	S	*	*			trans	-155.8	125.2	142.2	-112.6	2.4	0	0	0	111.2
393	Q	35.8	Very low	36.3	Very low	173 Å²	173	154.6 Å²	154.6	81%	0.808	85%	0.846	S	S	*	*			trans	-87.6	142.7	167.6	-79.4	173.2	-21.2	0	0	108.6
394	E	36.6	Very low	36.3	Very low	197 Å²	197	154.5 Å²	154.5	92%	0.921	85%	0.851	S	S	*	*			trans	-133.6	116.2	156	-114.3	174.6	-179.4	0	0	109.6
395	Q	36.9	Very low	36.1	Very low	158 Å²	158	152.7 Å²	152.7	74%	0.738	85%	0.852	S	S	*	*			trans	-87.3	137.4	170.1	-69.7	177.7	-19.5	0	0	108.3
396	N	38.1	Very low	35.9	Very low	170 Å²	170	158.8 Å²	158.8	91%	0.909	86%	0.859	S	S	*	*			trans	-139.2	108.2	153.2	-98.9	-30.7	0	0	0	110.1
397	R	33	Very low	35.8	Very low	239 Å²	239	158.1 Å²	158.1	90%	0.902	86%	0.855	S	S	*	*			trans	-94.3	131.6	165.5	-73.8	177.9	169.6	179.2	-3.1	107.5
398	S	41.1	Very low	35.8	Very low	126 Å²	126	158.2 Å²	158.2	88%	0.881	85%	0.851	S	S	*	*			trans	-138.6	121.8	152.7	61.8	0	0	0	0	110
399	S	34.2	Very low	35.5	Very low	126 Å²	126	163 Å²	163	88%	0.881	85%	0.852	S	S	*	*			trans	-96	129.8	177.7	51.3	0	0	0	0	109.4
400	G	38.1	Very low	35.7	Very low	80 Å²	80	158.6 Å²	158.6	83%	0.825	85%	0.847	S	S	*	*			trans	-133.5	119.9	172.3	0	0	0	0	0	110.7
401	K	37.9	Very low	35.6	Very low	204 Å²	204	153.6 Å²	153.6	89%	0.887	84%	0.843	S	S	*	*			trans	-71	142	-169.5	-82.4	169.1	172.4	169.1	0	114.9
402	S	30.3	Very low	35.7	Very low	104 Å²	104	157.8 Å²	157.8	73%	0.727	85%	0.845	S	S	*	*			trans	0	139.3	144.8	50.7	0	0	0	0	121
403	K	39.4	Very low	35.7	Very low	213 Å²	213	156.7 Å²	156.7	93%	0.926	83%	0.834	S	S	*	*				-160.8	130.8	125.1	-108.1	171.5	-174.6	179.5	0	111.9
404	T	33.5	Very low	35.5	Very low	146 Å²	146	154.8 Å²	154.8	90%	0.896	83%	0.834	S	S	*	*			trans	-83.7	150.2	177.1	41.9	0	0	0	0	111.2
405	G	36.6	Very low	35.5	Very low	86 Å²	86	149.5 Å²	149.5	89%	0.887	82%	0.819	S	S	*	*			trans	-164.7	111.5	170.6	0	0	0	0	0	110.8
406	R	32.7	Very low	35.3	Very low	236 Å²	236	148.7 Å²	148.7	89%	0.891	82%	0.82	S	S	*	*			trans	-109	135.6	-176.6	-151.3	-178	-160.8	165	3.8	107.5
407	N	36	Very low	35.1	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	82%	0.819	S	S	*	*			trans	175.8	109.3	151.3	-89	-13.3	0	0	0	108.2
408	T	33.7	Very low	35.1	Very low	110 Å²	110	145.2 Å²	145.2	68%	0.675	82%	0.818	S	S	*	*				63.7	111.6	83.1	53.8	0	0	0	0	117.2
409	R	35.1	Very low	34.8	Very low	232 Å²	232	150.3 Å²	150.3	88%	0.875	82%	0.818	S	S	*	*			trans	82.2	138.2	138.3	-69.7	-177.6	175.4	179.2	-0.7	121.5
410	S	36.2	Very low	34.9	Very low	111 Å²	111	151.8 Å²	151.8	78%	0.776	82%	0.815	S	S	*	*			trans	85.4	103	146.3	23.8	0	0	0	0	120.3
411	A	33.7	Very low	34.5	Very low	98 Å²	98	157.5 Å²	157.5	81%	0.81	82%	0.821	S	S	*	*				57.2	130.8	117.4	0	0	0	0	0	121
412	K	35.2	Very low	34.3	Very low	180 Å²	180	153 Å²	153	78%	0.783	82%	0.815	S	S	*	*			trans	116.7	108.1	130.2	-152.9	167.3	-175	-175.6	0	115.8
413	Q	35.9	Very low	34.1	Very low	152 Å²	152	153 Å²	153	71%	0.71	82%	0.815	S	S	*	*			trans	46.1	133.6	137.4	-75	173.1	-23.3	0	0	121.8
414	T	32.2	Very low	33.9	Very low	132 Å²	132	148.4 Å²	148.4	81%	0.81	81%	0.807	S	S	*	*			trans	66.5	141.3	144.3	56.5	0	0	0	0	116.7
415	S	34.8	Very low	33.6	Very low	87 Å²	87	150 Å²	150	61%	0.608	80%	0.804	S	S	*	*			cis	-165.6	167.9	-4.4	52.9	0	0	0	0	106.2
416	D	32.6	Very low	33.4	Very low	141 Å²	141	151.6 Å²	151.6	75%	0.754	80%	0.797	S	S	*	*			trans	56.9	102.2	154.4	-43.7	-39.7	0	0	0	119.2
417	T	35.3	Very low	33.5	Very low	146 Å²	146	147.3 Å²	147.3	90%	0.896	79%	0.792	S	S	*	*			trans	-159.9	125.6	132.9	-39.4	0	0	0	0	111.1
418	E	33.4	Very low	34	Very low	190 Å²	190	147.7 Å²	147.7	89%	0.888	79%	0.789	S	S	*	*			trans	-51.2	133.7	170.4	-59.1	171.2	150.2	0	0	112.6
419	R	33.5	Very low	35.1	Very low	232 Å²	232	146.7 Å²	146.7	88%	0.875	78%	0.778	S	S	*	*			trans	-154.6	102.6	162.2	-152.3	171.4	-175.8	-145.6	-0.4	112.5
420	L	36.8	Very low	36.4	Very low	157 Å²	157	141.2 Å²	141.2	82%	0.822	77%	0.766	S	S	*	*			trans	44.2	100.5	146.2	-70.6	153.9	0	0	0	117.3	S422	L420-S422 PolarHBondContact O-N 3.2Å
421	E	30.3	Very low	38.5	Very low	201 Å²	201	137.4 Å²	137.4	94%	0.939	74%	0.736	S	S	*	*			trans	-63	112.9	158.6	-71.2	-177.5	154.7	0	0	110.3
422	S	32.3	Very low	40.9	Very low	110 Å²	110	133 Å²	133	77%	0.769	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-94.4	122.4	157.3	54.1	0	0	0	0	108.1	L420	L420-S422 PolarHBondContact O-N 3.2Å
423	S	27.8	Very low	43.3	Very low	102 Å²	102	124.5 Å²	124.5	71%	0.713	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-53.8	140.8	178	68.9	0	0	0	0	110.9	E425	S423-E425 PolarHBondContact O-N 3.07Å; S423-E425 VanDerWaalsContact O-N 3.12Å
424	P	33.6	Very low	45.7	Very low	117 Å²	117	118.9 Å²	118.9	76%	0.76	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-65.1	119.7	173.5	27.8	-30.2	0	0	0	107.9	T426	P424-T426 PolarHBondContact O-N 3.29Å
425	E	28.7	Very low	48.2	Very low	179 Å²	179	115.5 Å²	115.5	84%	0.836	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-46.8	117.7	166	-71.1	176.1	157.6	0	0	107.7	S423 N427	S423-E425 PolarHBondContact O-N 3.07Å; S423-E425 VanDerWaalsContact O-N 3.12Å; E425-N427 VanDerWaalsContact C-N 3.31Å; E425-N427 PolarHBondContact O-N 2.72Å
426	T	31.6	Very low	50.7	Low	121 Å²	121	120.2 Å²	120.2	74%	0.742	62%	0.624	S	S	*	*			trans	-60.2	102.4	166.4	46.2	0	0	0	0	106	P424 E428	P424-T426 PolarHBondContact O-N 3.29Å; T426-E428 PolarHBondContact O-N 3Å
427	N	34.7	Very low	53.4	Low	146 Å²	146	114.9 Å²	114.9	78%	0.781	60%	0.6	S	S	*	*			trans	-57.6	86.9	158.5	-93.6	-19.8	0	0	0	105.7	E425 L429	E425-N427 VanDerWaalsContact C-N 3.31Å; E425-N427 PolarHBondContact O-N 2.72Å; N427-L429 VanDerWaalsContact C-N 3.29Å; N427-L429 PolarHBondContact O-N 2.73Å
428	E	45.8	Very low	56.2	Low	158 Å²	158	113.6 Å²	113.6	74%	0.738	59%	0.586	S	S	*	*			trans	-54.8	104.8	164	-76.5	-170.9	163.4	0	0	104.7	T426 I430	T426-E428 PolarHBondContact O-N 3Å; E428-I430 VanDerWaalsContact C-N 3.26Å; E428-I430 PolarHBondContact O-N 2.86Å
429	L	57.1	Low	59.1	Low	88 Å²	88	111.5 Å²	111.5	46%	0.461	57%	0.571	S	S	.	*			trans	-56.1	101.8	170.7	-109	84.1	0	0	0	105.8	R270 N427 N431	R270-L429 HydrophobicContact CB-CD2 4.08Å; N427-L429 VanDerWaalsContact C-N 3.29Å; N427-L429 PolarHBondContact O-N 2.73Å; L429-N431 PolarHBondContact O-N 3Å
430	I	62.8	Low	62	Low	118 Å²	118	102.8 Å²	102.8	61%	0.605	54%	0.544	S	S	*	.			trans	-58.5	124.9	176.3	-63.9	172.3	0	0	0	105.5	E428 P432	E428-I430 VanDerWaalsContact C-N 3.26Å; E428-I430 PolarHBondContact O-N 2.86Å; I430-P432 WeakPolarHBondContact O-CD 3.47Å; I430-P432 VanDerWaalsContact O-N 3.11Å
431	N	79.8	Confident	64.6	Low	30 Å²	30	102.9 Å²	102.9	16%	0.16	54%	0.54	C	S	.	.			trans	-56.1	119	179.6	-175.1	-28.7	0	0	0	108.5	M237 Y306 L429 I433 L434	M237-N431 PolarHBondContact O-ND2 3.14Å; Y306-N431 VanDerWaalsContact CE1-ND2 3.28Å; Y306-N431 WeakPolarHBondContact CE1-ND2 3.38Å; L429-N431 PolarHBondContact O-N 3Å; N431-I433 PolarHBondContact O-N 3.18Å; N431-I433 WeakPolarHBondContact OD1-CB 3.4Å; N431-I433 PolarHBondContact OD1-N 3.32Å; N431-L434 HydrophobicContact CB-CD1 4.18Å; N431-L434 HydrophobicContact CB-CG 4.15Å; N431-L434 WeakPolarHBondContact O-CA 3.34Å; N431-L434 VanDerWaalsContact O-CB 3.29Å; N431-L434 WeakPolarHBondContact O-CB 3.41Å; N431-L434 PolarHBondContact O-N 2.67Å
432	P	84.4	Confident	67.5	Low	7 Å²	7	98.2 Å²	98.2	5%	0.045	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-60	-22.6	-171.9	-25	33.8	0	0	0	113.9	R270 I430 L434 D435	R270-P432 HydrophobicContact CG-CB 4.36Å; R270-P432 HydrophobicContact CG-CG 3.36Å; I430-P432 WeakPolarHBondContact O-CD 3.47Å; I430-P432 VanDerWaalsContact O-N 3.11Å; P432-L434 PolarHBondContact O-N 2.82Å; P432-D435 VanDerWaalsContact O-CB 3.22Å; P432-D435 WeakPolarHBondContact O-CB 3.43Å; P432-D435 VanDerWaalsContact O-CG 3.27Å; P432-D435 PolarHBondContact O-N 3.35Å
433	I	86.7	Confident	70.2	Confident	0 Å²	0	100.8 Å²	100.8	0%	0	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-63	-21.9	174.6	-66.1	166.3	0	0	0	111.5	M237 T268 L299 E303 R307 N431	M237-I433 HydrophobicContact CB-CD1 4.26Å; M237-I433 HydrophobicContact CG-CD1 3.64Å; M237-I433 HydrophobicContact SD-CD1 4.39Å; T268-I433 HydrophobicContact CG2-CD1 3.42Å; T268-I433 VanDerWaalsContact CG2-CD1 3.42Å; T268-I433 HydrophobicContact CG2-CG1 4.02Å; L299-I433 HydrophobicContact CD1-CG2 4.39Å; L299-I433 HydrophobicContact CD2-CG2 4.19Å; E303-I433 HydrophobicContact CB-CD1 4.49Å; E303-I433 HydrophobicContact CB-CG2 4.09Å; E303-I433 HydrophobicContact CG-CD1 4Å; R307-I433 HydrophobicContact CB-CG2 4.13Å; R307-I433 PolarHBondContact NH1-O 3.43Å; N431-I433 PolarHBondContact O-N 3.18Å; N431-I433 WeakPolarHBondContact OD1-CB 3.4Å; N431-I433 PolarHBondContact OD1-N 3.32Å
434	L	85.3	Confident	73.3	Confident	34 Å²	34	96.4 Å²	96.4	18%	0.178	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-88.6	-3.7	177.4	-53.4	-177.1	0	0	0	113.3	R307 C310 N431 P432	R307-L434 HydrophobicContact CB-CD2 4.16Å; R307-L434 HydrophobicContact CG-CD2 3.86Å; C310-L434 HydrophobicContact CB-CD1 4.18Å; C310-L434 HydrophobicContact CB-CD2 3.96Å; N431-L434 HydrophobicContact CB-CD1 4.18Å; N431-L434 HydrophobicContact CB-CG 4.15Å; N431-L434 WeakPolarHBondContact O-CA 3.34Å; N431-L434 VanDerWaalsContact O-CB 3.29Å; N431-L434 WeakPolarHBondContact O-CB 3.41Å; N431-L434 PolarHBondContact O-N 2.67Å; P432-L434 PolarHBondContact O-N 2.82Å
435	D	84.8	Confident	76.3	Confident	61 Å²	61	92.8 Å²	92.8	33%	0.326	47%	0.466	S	S	.	.	S	Bend	trans	-59.9	166.6	179.5	-71.3	-16.6	0	0	0	111.9	R307 P432 A437	R307-D435 VanDerWaalsContact CZ-O 3.28Å; R307-D435 PolarHBondContact NH1-O 2.91Å; R307-D435 PolarHBondContact NH2-O 3.44Å; P432-D435 VanDerWaalsContact O-CB 3.22Å; P432-D435 WeakPolarHBondContact O-CB 3.43Å; P432-D435 VanDerWaalsContact O-CG 3.27Å; P432-D435 PolarHBondContact O-N 3.35Å; D435-A437 PolarHBondContact O-N 2.99Å
436	K	86.9	Confident	79.5	Confident	186 Å²	186	85.3 Å²	85.3	81%	0.809	43%	0.432	S	S	*	.			trans	-56.1	126.1	176.3	-69.9	-177.9	-179.2	176	0	109.3
437	A	90.5	Very high	82.4	Confident	30 Å²	30	79.6 Å²	79.6	25%	0.248	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.5	179.8	0	0	0	0	0	110	D435 L445 L446 I447	D435-A437 PolarHBondContact O-N 2.99Å; A437-L445 HydrophobicContact CB-CB 4.11Å; A437-L445 HydrophobicContact CB-CD2 4.17Å; A437-L446 CarbonylContact C-O 3.27Å; A437-L446 VanDerWaalsContact CA-O 3.24Å; A437-L446 WeakPolarHBondContact CA-O 3.16Å; A437-I447 HydrophobicContact CB-CG2 3.52Å
438	I	93.1	Very high	85.2	Confident	119 Å²	119	74.2 Å²	74.2	61%	0.61	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.5	173.2	-59.2	172.3	0	0	0	107.4	V440 L446	I438-V440 HydrophobicContact CG2-CG2 4.22Å; I438-L446 PolarHBondContact N-O 3.45Å; I438-L446 WeakPolarHBondContact O-CB 3.24Å; I438-L446 PolarHBondContact O-N 3.37Å
439	Y	94.1	Very high	87.5	Confident	146 Å²	146	66.9 Å²	66.9	57%	0.573	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.4	172.3	-175.2	-99.6	0	0	0	109.7	E441 G444 L445	Y439-E441 HydrophobicContact CE1-CB 4.1Å; Y439-G444 WeakPolarHBondContact CA-O 3.18Å; Y439-L445 HydrophobicContact CD2-CD2 4.09Å
440	V	94.9	Very high	89.3	Confident	49 Å²	49	62.8 Å²	62.8	30%	0.297	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114.4	176.7	-172.8	0	0	0	0	108.1	F298 I438 Y443 G444 L446	F298-V440 HydrophobicContact CE1-CB 3.94Å; F298-V440 HydrophobicContact CE1-CG2 4.26Å; F298-V440 HydrophobicContact CZ-CB 4.2Å; I438-V440 HydrophobicContact CG2-CG2 4.22Å; V440-Y443 HydrophobicContact CG1-CD2 4.14Å; V440-Y443 WeakPolarHBondContact O-CA 3.21Å; V440-Y443 PolarHBondContact O-N 3.2Å; V440-G444 PolarHBondContact N-O 2.98Å; V440-G444 PolarHBondContact O-N 3.06Å; V440-L446 HydrophobicContact CG2-CB 4.11Å; V440-L446 HydrophobicContact CG2-CD2 3.94Å
441	E	91.5	Very high	90.8	Very high	158 Å²	158	57.2 Å²	57.2	74%	0.738	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	137.7	177.4	-164.5	170.2	-175.7	0	0	110.4	Y439	Y439-E441 HydrophobicContact CE1-CB 4.1Å
442	P	91.3	Very high	91.6	Very high	104 Å²	104	57.6 Å²	57.6	68%	0.675	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	cis	-92.4	10.8	-1.3	37.9	-36.5	0	0	0	114.4
443	Y	89.5	Confident	92.1	Very high	163 Å²	163	57.3 Å²	57.3	64%	0.639	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-35.3	-165.1	-58.1	-73	0	0	0	115	F298 V440	F298-Y443 HydrophobicContact CE1-CG 4.32Å; F298-Y443 HydrophobicContact CE2-CG 4.08Å; F298-Y443 HydrophobicContact CZ-CD2 4.05Å; F298-Y443 AromaticContact CZ-CG 3.84Å; F298-Y443 HydrophobicContact CZ-CG 3.84Å; V440-Y443 HydrophobicContact CG1-CD2 4.14Å; V440-Y443 WeakPolarHBondContact O-CA 3.21Å; V440-Y443 PolarHBondContact O-N 3.2Å
444	G	93.4	Very high	92.6	Very high	11 Å²	11	58 Å²	58	11%	0.113	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118	-149.4	179.6	0	0	0	0	0	114	Y439 V440	Y439-G444 WeakPolarHBondContact CA-O 3.18Å; V440-G444 PolarHBondContact N-O 2.98Å; V440-G444 PolarHBondContact O-N 3.06Å
445	L	95.6	Very high	93.2	Very high	40 Å²	40	59.3 Å²	59.3	21%	0.209	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	114.6	-175.5	-68	180	0	0	0	111	F298 L299 I304 A437 Y439	F298-L445 CarbonylContact C-O 3.58Å; F298-L445 WeakPolarHBondContact CA-O 3.34Å; L299-L445 HydrophobicContact CB-CB 4.42Å; L299-L445 HydrophobicContact CD1-CB 4.09Å; L299-L445 HydrophobicContact CD1-CD1 4.31Å; L299-L445 HydrophobicContact CG-CB 4.36Å; L299-L445 PolarHBondContact N-O 3.47Å; I304-L445 HydrophobicContact CG1-CD1 4.33Å; A437-L445 HydrophobicContact CB-CB 4.11Å; A437-L445 HydrophobicContact CB-CD2 4.17Å; Y439-L445 HydrophobicContact CD2-CD2 4.09Å
446	L	95.1	Very high	93.9	Very high	22 Å²	22	56.4 Å²	56.4	12%	0.115	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.5	175.9	-174	59.9	0	0	0	110	Q296 F298 A437 I438 V440	Q296-L446 HydrophobicContact CB-CD1 4.05Å; Q296-L446 HydrophobicContact CB-CG 4.48Å; Q296-L446 HydrophobicContact CG-CD1 4.05Å; Q296-L446 VanDerWaalsContact OE1-CD2 3.31Å; F298-L446 HydrophobicContact CD1-CB 4Å; F298-L446 HydrophobicContact CD1-CD1 4.19Å; F298-L446 HydrophobicContact CD2-CD1 4.28Å; F298-L446 HydrophobicContact CE1-CB 3.71Å; F298-L446 HydrophobicContact CE1-CD1 4.06Å; F298-L446 HydrophobicContact CE1-CD2 4.49Å; F298-L446 HydrophobicContact CE1-CG 4.32Å; F298-L446 HydrophobicContact CE2-CD1 4.17Å; F298-L446 HydrophobicContact CG-CD1 4.29Å; F298-L446 HydrophobicContact CZ-CB 4.37Å; F298-L446 HydrophobicContact CZ-CD1 4.05Å; F298-L446 HydrophobicContact CZ-CD2 4.38Å; A437-L446 CarbonylContact C-O 3.27Å; A437-L446 VanDerWaalsContact CA-O 3.24Å; A437-L446 WeakPolarHBondContact CA-O 3.16Å; I438-L446 PolarHBondContact N-O 3.45Å; I438-L446 WeakPolarHBondContact O-CB 3.24Å; I438-L446 PolarHBondContact O-N 3.37Å; V440-L446 HydrophobicContact CG2-CB 4.11Å; V440-L446 HydrophobicContact CG2-CD2 3.94Å
447	I	93.9	Very high	94.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	157	175	64	158.9	0	0	0	111.6	Q296 F297 L299 A437	Q296-I447 WeakPolarHBondContact CA-O 3.41Å; Q296-I447 VanDerWaalsContact CB-O 3.28Å; Q296-I447 WeakPolarHBondContact CB-O 3.29Å; F297-I447 HydrophobicContact CD2-CD1 4.25Å; F297-I447 HydrophobicContact CD2-CG1 3.82Å; F297-I447 HydrophobicContact CE2-CD1 3.44Å; F297-I447 VanDerWaalsContact CE2-CD1 3.44Å; F297-I447 HydrophobicContact CE2-CG1 3.53Å; F297-I447 HydrophobicContact CZ-CD1 3.67Å; F297-I447 HydrophobicContact CZ-CG1 4Å; F297-I447 PolarHBondContact N-O 2.99Å; F297-I447 VanDerWaalsContact N-O 3.08Å; F297-I447 PolarHBondContact O-N 2.78Å; L299-I447 HydrophobicContact CD1-CG2 4.26Å; L299-I447 HydrophobicContact CD2-CD1 3.68Å; L299-I447 HydrophobicContact CD2-CG1 3.9Å; L299-I447 HydrophobicContact CD2-CG2 4.35Å; L299-I447 HydrophobicContact CG-CG1 4.42Å; L299-I447 HydrophobicContact CG-CG2 4.19Å; A437-I447 HydrophobicContact CB-CG2 3.52Å
448	V	93.3	Very high	94.8	Very high	32 Å²	32	47.2 Å²	47.2	19%	0.194	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	137.9	170.7	-176.8	0	0	0	0	109.2	F451 L481 L491	V448-F451 HydrophobicContact CG1-CD2 3.63Å; V448-F451 HydrophobicContact CG1-CE2 3.33Å; V448-F451 HydrophobicContact CG1-CZ 4.1Å; V448-L481 HydrophobicContact CG1-CD2 3.81Å; V448-L481 HydrophobicContact CG2-CD2 4.16Å; V448-L491 HydrophobicContact CG1-CD2 4.05Å
449	G	94.7	Very high	95.1	Very high	5 Å²	5	42 Å²	42	5%	0.052	21%	0.21	C	C	.	.			trans	-78.3	-155.5	-178.2	0	0	0	0	0	114.4	V293 S295 F451	V293-G449 CarbonylContact O-C 3.58Å; V293-G449 WeakPolarHBondContact O-CA 3.44Å; S295-G449 WeakPolarHBondContact O-CA 3.15Å; S295-G449 PolarHBondContact O-N 3.08Å; G449-F451 PolarHBondContact O-N 3.29Å
450	N	95	Very high	95.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.208	C	C	.	.			trans	-85.7	103.4	-177.5	-168.4	-31.9	0	0	0	110.9	L266 N269 R270 V293 I452 L453 Q478	L266-N450 PolarHBondContact O-ND2 3.17Å; N269-N450 PolarHBondContact O-ND2 2.91Å; R270-N450 PolarHBondContact NH1-ND2 3.27Å; V293-N450 HydrophobicContact CG1-CB 4.09Å; V293-N450 PolarHBondContact O-N 3.28Å; N450-I452 PolarHBondContact OD1-N 3Å; N450-L453 PolarHBondContact OD1-N 3.13Å; N450-Q478 PolarHBondContact O-NE2 2.89Å
451	F	94.3	Very high	95.5	Very high	2 Å²	2	40 Å²	40	1%	0.009	20%	0.197	C	C	.	.			trans	-98.3	11.7	174	-79.5	-115.6	0	0	0	112.3	V448 G449 Y477 Q478 L481 L482 L491 G492 T493 G494	V448-F451 HydrophobicContact CG1-CD2 3.63Å; V448-F451 HydrophobicContact CG1-CE2 3.33Å; V448-F451 HydrophobicContact CG1-CZ 4.1Å; G449-F451 PolarHBondContact O-N 3.29Å; F451-Y477 HydrophobicContact CE2-CD1 4.43Å; F451-Y477 AromaticContact CE2-CE1 3.92Å; F451-Y477 HydrophobicContact CE2-CE1 3.92Å; F451-Y477 HydrophobicContact CZ-CD1 4.13Å; F451-Y477 AromaticContact CZ-CE1 3.82Å; F451-Y477 HydrophobicContact CZ-CE1 3.82Å; F451-Q478 HydrophobicContact CD1-CG 4.38Å; F451-Q478 HydrophobicContact CE1-CB 3.81Å; F451-Q478 HydrophobicContact CE1-CG 3.78Å; F451-Q478 HydrophobicContact CE2-CG 4.06Å; F451-Q478 HydrophobicContact CZ-CB 3.99Å; F451-Q478 HydrophobicContact CZ-CG 3.61Å; F451-L481 HydrophobicContact CE1-CB 4.41Å; F451-L481 HydrophobicContact CE1-CD2 4.12Å; F451-L481 HydrophobicContact CE2-CD2 4.21Å; F451-L481 HydrophobicContact CZ-CB 4.26Å; F451-L481 HydrophobicContact CZ-CD2 3.59Å; F451-L482 HydrophobicContact CD1-CD1 3.85Å; F451-L482 HydrophobicContact CD1-CD2 3.99Å; F451-L482 HydrophobicContact CD1-CG 3.96Å; F451-L482 HydrophobicContact CE1-CD1 3.87Å; F451-L482 HydrophobicContact CE1-CD2 4.2Å; F451-L482 HydrophobicContact CE1-CG 3.76Å; F451-L491 CarbonylContact C-O 3.58Å; F451-L491 HydrophobicContact CB-CB 3.95Å; F451-L491 WeakPolarHBondContact CB-O 3.39Å; F451-L491 HydrophobicContact CD1-CB 4.2Å; F451-L491 HydrophobicContact CG-CB 4.16Å; F451-G492 CarbonylContact O-C 3.56Å; F451-G492 VanDerWaalsContact O-CA 3.28Å; F451-G492 WeakPolarHBondContact O-CA 3.26Å; F451-T493 PolarHBondContact O-N 3.48Å; F451-G494 WeakPolarHBondContact O-CA 3.07Å; F451-G494 PolarHBondContact O-N 3.26Å
452	I	94.9	Very high	95.8	Very high	38 Å²	38	35.7 Å²	35.7	20%	0.195	18%	0.184	C	C	.	.	S	Bend	trans	-94.1	-36.8	176.6	-61.8	-64.3	0	0	0	111.2	R270 L273 N450 A454	R270-I452 HydrophobicContact CB-CG1 3.92Å; R270-I452 HydrophobicContact CG-CG1 4.38Å; L273-I452 HydrophobicContact CD2-CG2 3.59Å; L273-I452 WeakPolarHBondContact CD2-O 3.39Å; N450-I452 PolarHBondContact OD1-N 3Å; I452-A454 PolarHBondContact O-N 2.92Å; I452-A454 VanDerWaalsContact O-N 3.07Å
453	L	96.4	Very high	96.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.			trans	-62.3	113.6	177.5	-170.5	69.9	0	0	0	110.1	L266 L275 I294 N450 L456 G494 I495	L266-L453 HydrophobicContact CD1-CD2 4.35Å; L275-L453 HydrophobicContact CB-CD1 3.93Å; I294-L453 HydrophobicContact CD1-CD2 4.22Å; I294-L453 HydrophobicContact CG1-CD2 4.42Å; N450-L453 PolarHBondContact OD1-N 3.13Å; L453-L456 HydrophobicContact CD2-CB 4.33Å; L453-G494 CarbonylContact O-C 3.47Å; L453-I495 HydrophobicContact CB-CD1 4.36Å; L453-I495 HydrophobicContact CD2-CD1 4.08Å; L453-I495 HydrophobicContact CG-CD1 4.04Å; L453-I495 WeakPolarHBondContact O-CD1 3.08Å; L453-I495 PolarHBondContact O-N 3.18Å
454	A	96.6	Very high	96.5	Very high	16 Å²	16	23.6 Å²	23.6	13%	0.132	13%	0.128	C	C	.	.			trans	-103.1	-27.5	-175.2	0	0	0	0	0	113.4	L273 I452 G494 L496 T497	L273-A454 PolarHBondContact O-N 3.44Å; I452-A454 PolarHBondContact O-N 2.92Å; I452-A454 VanDerWaalsContact O-N 3.07Å; A454-G494 WeakPolarHBondContact CA-O 3.33Å; A454-L496 HydrophobicContact CB-CD1 4.47Å; A454-L496 PolarHBondContact O-N 3.2Å; A454-T497 PolarHBondContact O-N 3.18Å
455	F	98	Very high	96.7	Very high	60 Å²	60	26.9 Å²	26.9	26%	0.263	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126	178.3	178.7	-81.2	0	0	0	110.2	L273 T274 L275 N457 T497 L499	L273-F455 PolarHBondContact O-N 3.44Å; T274-F455 WeakPolarHBondContact CA-O 3.38Å; T274-F455 HydrophobicContact CG2-CB 3.76Å; T274-F455 HydrophobicContact CG2-CG 4.48Å; L275-F455 PolarHBondContact N-O 3.5Å; F455-N457 HydrophobicContact CE1-CB 3.58Å; F455-N457 HydrophobicContact CZ-CB 3.93Å; F455-T497 WeakPolarHBondContact CA-O 3.18Å; F455-T497 HydrophobicContact CD2-CG2 3.59Å; F455-T497 HydrophobicContact CE2-CG2 3.65Å; F455-L499 HydrophobicContact CE2-CD1 3.98Å; F455-L499 HydrophobicContact CE2-CG 4.27Å; F455-L499 HydrophobicContact CZ-CD1 3.66Å; F455-L499 HydrophobicContact CZ-CG 4.21Å
456	L	98.5	Very high	96.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.7	172.8	177.2	61	0	0	0	110.1	L275 L290 I294 L453 L458 I495 T497 L498 L499	L275-L456 HydrophobicContact CB-CD1 4.24Å; L275-L456 HydrophobicContact CD2-CD1 4.25Å; L275-L456 HydrophobicContact CG-CD1 4.27Å; L275-L456 WeakPolarHBondContact O-CA 3.44Å; L290-L456 HydrophobicContact CD1-CD1 4.46Å; I294-L456 HydrophobicContact CD1-CD2 3.63Å; L453-L456 HydrophobicContact CD2-CB 4.33Å; L456-L458 HydrophobicContact CD1-CG 4.3Å; L456-L458 HydrophobicContact CD2-CD1 3.8Å; L456-L458 HydrophobicContact CD2-CG 4.19Å; L456-L458 HydrophobicContact CG-CD1 4.11Å; L456-L458 HydrophobicContact CG-CG 4Å; L456-I495 HydrophobicContact CB-CD1 4Å; L456-T497 PolarHBondContact N-O 2.85Å; L456-L498 HydrophobicContact CB-CD1 3.77Å; L456-L498 HydrophobicContact CD2-CD1 3.81Å; L456-L498 HydrophobicContact CG-CD1 3.9Å; L456-L498 WeakPolarHBondContact O-CA 3.35Å; L456-L499 PolarHBondContact O-N 3.41Å
457	N	98.7	Very high	97	Very high	23 Å²	23	28.4 Å²	28.4	12%	0.123	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	111.3	174.9	-179.3	12.8	0	0	0	111.3	L275 S276 V277 S278 F455 S459 L499	L275-N457 PolarHBondContact O-N 3.34Å; S276-N457 WeakPolarHBondContact OG-CB 3.15Å; S276-N457 PolarHBondContact OG-ND2 2.95Å; S276-N457 VanDerWaalsContact OG-ND2 3.13Å; V277-N457 CarbonylContact C-O 3.6Å; V277-N457 PolarHBondContact N-O 3.01Å; S278-N457 PolarHBondContact N-O 2.91Å; F455-N457 HydrophobicContact CE1-CB 3.58Å; F455-N457 HydrophobicContact CZ-CB 3.93Å; N457-S459 VanDerWaalsContact OD1-CB 3.29Å; N457-S459 WeakPolarHBondContact OD1-CB 3.15Å; N457-S459 PolarHBondContact OD1-N 2.91Å; N457-S459 PolarHBondContact OD1-OG 3.45Å; N457-L499 HydrophobicContact CB-CB 4.2Å; N457-L499 HydrophobicContact CB-CD1 4.31Å; N457-L499 WeakPolarHBondContact OD1-CB 3.49Å
458	L	98.7	Very high	97.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.			trans	-111.3	9.1	178.5	-72.1	166.5	0	0	0	112.5	V277 I282 L290 L456 N461 I463 L471 L498 L499 N503	V277-L458 HydrophobicContact CG2-CD2 3.69Å; I282-L458 HydrophobicContact CD1-CD2 4.26Å; L290-L458 HydrophobicContact CD1-CD2 3.77Å; L456-L458 HydrophobicContact CD1-CG 4.3Å; L456-L458 HydrophobicContact CD2-CD1 3.8Å; L456-L458 HydrophobicContact CD2-CG 4.19Å; L456-L458 HydrophobicContact CG-CD1 4.11Å; L456-L458 HydrophobicContact CG-CG 4Å; L458-N461 PolarHBondContact O-ND2 3.14Å; L458-I463 HydrophobicContact CB-CD1 3.85Å; L458-I463 HydrophobicContact CD1-CD1 4.28Å; L458-I463 HydrophobicContact CD2-CD1 4.16Å; L458-I463 HydrophobicContact CG-CD1 4.33Å; L458-L471 HydrophobicContact CD1-CD1 4.06Å; L458-L471 HydrophobicContact CD1-CD2 4.06Å; L458-L498 HydrophobicContact CD1-CD1 4.39Å; L458-L499 WeakPolarHBondContact CA-O 3.47Å; L458-L499 PolarHBondContact N-O 3.31Å; L458-N503 PolarHBondContact O-ND2 2.95Å; L458-N503 VanDerWaalsContact O-ND2 3.08Å
459	S	98.5	Very high	97.4	Very high	9 Å²	9	32 Å²	32	6%	0.063	16%	0.164	C	C	.	.			trans	-61.5	155.6	-175.7	-44.9	0	0	0	0	112.3	S278 N279 N457 N461 L499 D501	S278-S459 CarbonylContact C-O 3.57Å; S278-S459 WeakPolarHBondContact CA-O 3.4Å; S278-S459 VanDerWaalsContact CB-O 3.23Å; S278-S459 WeakPolarHBondContact CB-O 3.36Å; S278-S459 PolarHBondContact OG-O 3.27Å; N279-S459 PolarHBondContact N-O 3.4Å; N457-S459 VanDerWaalsContact OD1-CB 3.29Å; N457-S459 WeakPolarHBondContact OD1-CB 3.15Å; N457-S459 PolarHBondContact OD1-N 2.91Å; N457-S459 PolarHBondContact OD1-OG 3.45Å; S459-N461 PolarHBondContact O-N 3.25Å; S459-N461 PolarHBondContact O-ND2 3.35Å; S459-L499 PolarHBondContact N-O 3.19Å; S459-L499 WeakPolarHBondContact OG-CB 3.47Å; S459-D501 CarbonylContact C-O 3.58Å; S459-D501 WeakPolarHBondContact CA-O 3.28Å; S459-D501 VanDerWaalsContact CB-O 3.31Å; S459-D501 WeakPolarHBondContact CB-O 3.41Å; S459-D501 PolarHBondContact OG-N 3.16Å
460	R	98.3	Very high	97.6	Very high	142 Å²	142	32.5 Å²	32.5	54%	0.536	17%	0.167	S	C	.	.	S	Bend	trans	61.9	38.9	176.8	-60.1	176.2	178	177.6	2.3	113.3	N279 D501 D502	N279-R460 WeakPolarHBondContact CA-O 3.48Å; N279-R460 HydrophobicContact CB-CB 3.96Å; N279-R460 PolarHBondContact N-O 3.06Å; R460-D501 PolarHBondContact N-O 3.2Å; R460-D502 CarbonylContact C-O 3.6Å; R460-D502 WeakPolarHBondContact CA-O 3.41Å; R460-D502 HydrophobicContact CB-CB 4.33Å; R460-D502 HydrophobicContact CG-CB 3.61Å; R460-D502 WeakPolarHBondContact CG-OD2 3.27Å; R460-D502 PolarHBondContact N-O 2.92Å; R460-D502 IonicContact NE-OD2 2.84Å; R460-D502 PolarHBondContact NE-OD2 3.23Å
461	N	98.6	Very high	97.8	Very high	12 Å²	12	32.6 Å²	32.6	6%	0.064	17%	0.168	C	C	.	.	S	Bend	trans	-113.9	-165.7	174.9	-80.4	-64.4	0	0	0	109.8	V277 N280 K281 I282 L458 S459 I463 D502 N503	V277-N461 PolarHBondContact O-ND2 3.34Å; V277-N461 VanDerWaalsContact O-ND2 3.14Å; N280-N461 WeakPolarHBondContact CA-OD1 3.16Å; N280-N461 PolarHBondContact N-OD1 3.21Å; K281-N461 PolarHBondContact N-OD1 3.37Å; K281-N461 VanDerWaalsContact N-OD1 3.09Å; I282-N461 HydrophobicContact CB-CB 4.03Å; I282-N461 WeakPolarHBondContact CB-OD1 3.29Å; I282-N461 WeakPolarHBondContact CG1-OD1 3.39Å; I282-N461 PolarHBondContact N-OD1 2.75Å; I282-N461 WeakPolarHBondContact O-CB 3.23Å; L458-N461 PolarHBondContact O-ND2 3.14Å; S459-N461 PolarHBondContact O-N 3.25Å; S459-N461 PolarHBondContact O-ND2 3.35Å; N461-I463 HydrophobicContact CB-CD1 4.23Å; N461-I463 HydrophobicContact CB-CG1 4.08Å; N461-D502 PolarHBondContact N-O 2.95Å; N461-N503 VanDerWaalsContact CA-OD1 3.28Å; N461-N503 WeakPolarHBondContact CA-OD1 3.4Å; N461-N503 WeakPolarHBondContact CB-OD1 3.43Å; N461-N503 PolarHBondContact N-OD1 3Å; N461-N503 PolarHBondContact O-OD1 3.45Å
462	S	98.3	Very high	98	Very high	67 Å²	67	34 Å²	34	47%	0.469	18%	0.175	S	C	.	.			trans	-116.1	35.4	178.7	-55.8	0	0	0	0	111	I282 N503	I282-S462 CarbonylContact O-C 3.55Å; I282-S462 VanDerWaalsContact O-C 3.27Å; I282-S462 WeakPolarHBondContact O-CA 3.23Å; I282-S462 PolarHBondContact O-N 3.08Å; S462-N503 PolarHBondContact N-OD1 2.9Å
463	I	98.5	Very high	98.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.			trans	-72.6	127.7	179.5	-56.5	169.3	0	0	0	108.2	I282 C287 L458 N461 N503 A504 F505	I282-I463 HydrophobicContact CG2-CG1 4.41Å; I282-I463 PolarHBondContact O-N 3.4Å; C287-I463 HydrophobicContact CB-CD1 3.94Å; C287-I463 HydrophobicContact CB-CG1 3.99Å; C287-I463 HydrophobicContact CB-CG2 3.9Å; L458-I463 HydrophobicContact CB-CD1 3.85Å; L458-I463 HydrophobicContact CD1-CD1 4.28Å; L458-I463 HydrophobicContact CD2-CD1 4.16Å; L458-I463 HydrophobicContact CG-CD1 4.33Å; N461-I463 HydrophobicContact CB-CD1 4.23Å; N461-I463 HydrophobicContact CB-CG1 4.08Å; I463-N503 HydrophobicContact CB-CB 4.29Å; I463-N503 VanDerWaalsContact CB-OD1 3.26Å; I463-N503 WeakPolarHBondContact CB-OD1 3.24Å; I463-N503 WeakPolarHBondContact CG1-OD1 3.26Å; I463-N503 PolarHBondContact N-OD1 3.39Å; I463-A504 CarbonylContact O-C 3.48Å; I463-A504 VanDerWaalsContact O-CA 3.28Å; I463-A504 WeakPolarHBondContact O-CA 3.36Å; I463-A504 WeakPolarHBondContact O-CB 3.24Å; I463-A504 PolarHBondContact O-N 3.45Å; I463-F505 HydrophobicContact CB-CE1 4.3Å; I463-F505 HydrophobicContact CG2-CE1 4.22Å; I463-F505 WeakPolarHBondContact O-CD1 3.32Å
464	G	98.3	Very high	98.2	Very high	13 Å²	13	37.7 Å²	37.7	13%	0.134	19%	0.192	C	C	.	.			trans	-98.1	-162.7	176.5	0	0	0	0	0	112.6	D284 N466 G467 L468	D284-G464 WeakPolarHBondContact OD1-CA 3.41Å; D284-G464 PolarHBondContact OD1-N 3.23Å; G464-N466 VanDerWaalsContact C-N 3.29Å; G464-N466 PolarHBondContact O-N 3.48Å; G464-G467 PolarHBondContact O-N 2.9Å; G464-L468 PolarHBondContact O-N 3.42Å; G464-L468 VanDerWaalsContact O-N 3.14Å
465	I	97.5	Very high	98.3	Very high	81 Å²	81	37.1 Å²	37.1	42%	0.415	19%	0.187	S	C	.	.	H	α-helix	trans	-66.3	-29.6	-174.3	-161.5	65.6	0	0	0	113	L468 K469 M511	I465-L468 HydrophobicContact CD1-CD2 4.33Å; I465-L468 PolarHBondContact O-N 3.4Å; I465-K469 WeakPolarHBondContact O-CB 3.28Å; I465-K469 PolarHBondContact O-N 2.95Å; I465-M511 HydrophobicContact CD1-CE 3.14Å; I465-M511 HydrophobicContact CG1-CE 3.6Å
466	N	98.1	Very high	98.2	Very high	94 Å²	94	36.5 Å²	36.5	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-74.4	-38.1	-179	-51.4	-65.6	0	0	0	111.2	D284 G464 K469 A470	D284-N466 HydrophobicContact CB-CB 4.32Å; D284-N466 VanDerWaalsContact OD2-CB 3.31Å; D284-N466 WeakPolarHBondContact OD2-CB 3.43Å; D284-N466 PolarHBondContact OD2-ND2 3.1Å; G464-N466 VanDerWaalsContact C-N 3.29Å; G464-N466 PolarHBondContact O-N 3.48Å; N466-K469 PolarHBondContact O-N 3.31Å; N466-A470 PolarHBondContact O-N 2.84Å
467	G	98.3	Very high	98.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-42.8	172.7	0	0	0	0	0	111.4	D284 G464 K469 A470 L471	D284-G467 VanDerWaalsContact CG-N 3.31Å; D284-G467 WeakPolarHBondContact OD1-CA 3.49Å; D284-G467 PolarHBondContact OD1-N 2.97Å; G464-G467 PolarHBondContact O-N 2.9Å; G467-K469 PolarHBondContact O-N 2.99Å; G467-A470 PolarHBondContact O-N 3.42Å; G467-L471 WeakPolarHBondContact O-CG 3.33Å; G467-L471 PolarHBondContact O-N 2.77Å
468	L	98	Very high	97.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.4	-43.7	174.6	-175	63.3	0	0	0	112.1	G464 I465 A470 L471 L472 F500 F505 C509 M511 I512 I515	G464-L468 PolarHBondContact O-N 3.42Å; G464-L468 VanDerWaalsContact O-N 3.14Å; I465-L468 HydrophobicContact CD1-CD2 4.33Å; I465-L468 PolarHBondContact O-N 3.4Å; L468-A470 PolarHBondContact O-N 3.22Å; L468-L471 PolarHBondContact O-N 3.34Å; L468-L472 PolarHBondContact O-N 3.48Å; L468-F500 HydrophobicContact CD1-CD2 4.4Å; L468-F500 HydrophobicContact CD1-CE2 4.25Å; L468-F505 HydrophobicContact CB-CD1 4.07Å; L468-F505 HydrophobicContact CB-CE1 4.26Å; L468-F505 HydrophobicContact CD1-CE1 4.41Å; L468-F505 HydrophobicContact CD1-CZ 4.31Å; L468-F505 HydrophobicContact CD2-CD1 4.33Å; L468-F505 HydrophobicContact CD2-CD2 4.08Å; L468-F505 HydrophobicContact CD2-CE2 4.41Å; L468-F505 HydrophobicContact CD2-CG 4.05Å; L468-C509 HydrophobicContact CD2-CB 4.28Å; L468-M511 HydrophobicContact CD2-CB 3.99Å; L468-M511 HydrophobicContact CD2-CE 4.21Å; L468-M511 HydrophobicContact CG-CB 4.14Å; L468-M511 HydrophobicContact CG-CE 4.42Å; L468-I512 HydrophobicContact CD1-CG1 4.25Å; L468-I512 HydrophobicContact CD2-CD1 4.43Å; L468-I512 HydrophobicContact CD2-CG1 3.78Å; L468-I515 HydrophobicContact CD1-CD1 3.58Å; L468-I515 HydrophobicContact CG-CD1 4.45Å
469	K	98.3	Very high	97.7	Very high	110 Å²	110	37.8 Å²	37.8	48%	0.478	19%	0.192	S	C	.	.	H	α-helix	trans	-59.5	-44.7	174.7	-176.8	-179	176.4	-175.7	0	111.9	I465 N466 G467 L471 L472 E473 M511	I465-K469 WeakPolarHBondContact O-CB 3.28Å; I465-K469 PolarHBondContact O-N 2.95Å; N466-K469 PolarHBondContact O-N 3.31Å; G467-K469 PolarHBondContact O-N 2.99Å; K469-L471 VanDerWaalsContact C-N 3.34Å; K469-L471 PolarHBondContact O-N 3.35Å; K469-L472 PolarHBondContact O-N 2.7Å; K469-E473 WeakPolarHBondContact CE-OE1 3.42Å; K469-E473 WeakPolarHBondContact O-CG 3.49Å; K469-E473 PolarHBondContact O-N 2.92Å; K469-M511 HydrophobicContact CB-CE 4.4Å; K469-M511 HydrophobicContact CB-SD 4Å; K469-M511 HydrophobicContact CG-SD 4.36Å
470	A	98.5	Very high	97.4	Very high	15 Å²	15	41.8 Å²	41.8	12%	0.124	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-38	178.1	0	0	0	0	0	112.5	I288 A291 N466 G467 L468 E473 A474	I288-A470 HydrophobicContact CB-CB 4.48Å; I288-A470 HydrophobicContact CG1-CB 3.73Å; A291-A470 HydrophobicContact CB-CB 3.91Å; N466-A470 PolarHBondContact O-N 2.84Å; G467-A470 PolarHBondContact O-N 3.42Å; L468-A470 PolarHBondContact O-N 3.22Å; A470-E473 PolarHBondContact O-N 3.06Å; A470-A474 WeakPolarHBondContact O-CB 3.44Å; A470-A474 PolarHBondContact O-N 3.06Å
471	L	98.4	Very high	97.1	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-46.2	172.8	-69.8	170.2	0	0	0	111.3	A291 L458 G467 L468 K469 E473 A474 I475 L498 I515	A291-L471 HydrophobicContact CB-CD2 4.31Å; L458-L471 HydrophobicContact CD1-CD1 4.06Å; L458-L471 HydrophobicContact CD1-CD2 4.06Å; G467-L471 WeakPolarHBondContact O-CG 3.33Å; G467-L471 PolarHBondContact O-N 2.77Å; L468-L471 PolarHBondContact O-N 3.34Å; K469-L471 VanDerWaalsContact C-N 3.34Å; K469-L471 PolarHBondContact O-N 3.35Å; L471-E473 PolarHBondContact O-N 3.39Å; L471-A474 PolarHBondContact O-N 3.33Å; L471-I475 WeakPolarHBondContact O-CG1 3.41Å; L471-I475 PolarHBondContact O-N 3.12Å; L471-L498 HydrophobicContact CB-CD2 4.3Å; L471-L498 HydrophobicContact CD1-CD2 4.24Å; L471-L498 HydrophobicContact CD2-CD1 4.43Å; L471-L498 HydrophobicContact CD2-CD2 4.23Å; L471-L498 HydrophobicContact CG-CD2 4.49Å; L471-I515 HydrophobicContact CB-CD1 4.24Å
472	L	98.3	Very high	96.6	Very high	31 Å²	31	35.8 Å²	35.8	16%	0.162	19%	0.191	C	C	.	.	H	α-helix	trans	-58.6	-46.2	176.7	175.5	60.7	0	0	0	111.8	L468 K469 A474 I475 T476 M511 I515 L518	L468-L472 PolarHBondContact O-N 3.48Å; K469-L472 PolarHBondContact O-N 2.7Å; L472-A474 VanDerWaalsContact C-N 3.33Å; L472-A474 PolarHBondContact O-N 2.96Å; L472-I475 PolarHBondContact O-N 2.98Å; L472-T476 VanDerWaalsContact O-CB 3.28Å; L472-T476 WeakPolarHBondContact O-CB 3.27Å; L472-T476 PolarHBondContact O-N 3.47Å; L472-T476 PolarHBondContact O-OG1 3.04Å; L472-M511 HydrophobicContact CD2-CB 4.03Å; L472-M511 HydrophobicContact CD2-CG 3.74Å; L472-M511 HydrophobicContact CD2-SD 4.06Å; L472-I515 HydrophobicContact CB-CD1 4.09Å; L472-I515 HydrophobicContact CB-CG1 3.93Å; L472-I515 HydrophobicContact CD1-CG1 3.83Å; L472-I515 HydrophobicContact CG-CG1 4.47Å; L472-L518 HydrophobicContact CD1-CD1 3.74Å
473	E	98.3	Very high	96	Very high	114 Å²	114	37.5 Å²	37.5	53%	0.533	20%	0.195	S	C	.	.	H	α-helix	trans	-59.7	-42.9	176.2	-73.1	175.6	-170.7	0	0	111.7	K469 A470 L471 Y477	K469-E473 WeakPolarHBondContact CE-OE1 3.42Å; K469-E473 WeakPolarHBondContact O-CG 3.49Å; K469-E473 PolarHBondContact O-N 2.92Å; A470-E473 PolarHBondContact O-N 3.06Å; L471-E473 PolarHBondContact O-N 3.39Å; E473-Y477 WeakPolarHBondContact O-CB 3.39Å; E473-Y477 PolarHBondContact O-N 3.34Å
474	A	98.1	Very high	95.3	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-46.7	178.6	0	0	0	0	0	112.9	A291 I294 A470 L471 L472 Y477 Q478	A291-A474 HydrophobicContact CB-CB 4.2Å; A291-A474 WeakPolarHBondContact O-CB 3.22Å; I294-A474 HydrophobicContact CG2-CB 4.44Å; A470-A474 WeakPolarHBondContact O-CB 3.44Å; A470-A474 PolarHBondContact O-N 3.06Å; L471-A474 PolarHBondContact O-N 3.33Å; L472-A474 VanDerWaalsContact C-N 3.33Å; L472-A474 PolarHBondContact O-N 2.96Å; A474-Y477 PolarHBondContact O-N 2.81Å; A474-Q478 WeakPolarHBondContact O-CG 3.38Å; A474-Q478 PolarHBondContact O-N 2.87Å
475	I	97.5	Very high	94	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-42.5	177.9	-62.9	-54.2	0	0	0	110.8	L471 L472 Y477 Q478 V479 I495 L498 L518 L519	L471-I475 WeakPolarHBondContact O-CG1 3.41Å; L471-I475 PolarHBondContact O-N 3.12Å; L472-I475 PolarHBondContact O-N 2.98Å; I475-Y477 VanDerWaalsContact C-N 3.31Å; I475-Y477 PolarHBondContact O-N 3.46Å; I475-Q478 PolarHBondContact O-N 3Å; I475-V479 HydrophobicContact CG2-CG2 4.07Å; I475-V479 WeakPolarHBondContact O-CG2 3.37Å; I475-V479 PolarHBondContact O-N 2.72Å; I475-I495 HydrophobicContact CD1-CB 3.59Å; I475-I495 HydrophobicContact CD1-CG1 3.95Å; I475-I495 HydrophobicContact CD1-CG2 3.78Å; I475-L498 HydrophobicContact CG1-CD2 4.42Å; I475-L518 HydrophobicContact CG2-CB 3.84Å; I475-L518 HydrophobicContact CG2-CD1 4.18Å; I475-L519 HydrophobicContact CD1-CD2 4.19Å; I475-L519 HydrophobicContact CG2-CD2 4Å; I475-L519 HydrophobicContact CG2-CG 4.3Å
476	T	97.2	Very high	92.2	Very high	47 Å²	47	45.2 Å²	45.2	29%	0.288	24%	0.236	S	C	.	.	H	α-helix	trans	-57.8	-45.5	175.9	-58.4	0	0	0	0	111.1	L472 V479 N480 L518	L472-T476 VanDerWaalsContact O-CB 3.28Å; L472-T476 WeakPolarHBondContact O-CB 3.27Å; L472-T476 PolarHBondContact O-N 3.47Å; L472-T476 PolarHBondContact O-OG1 3.04Å; T476-V479 PolarHBondContact O-N 2.81Å; T476-N480 WeakPolarHBondContact O-CB 3.47Å; T476-N480 PolarHBondContact O-N 3.4Å; T476-N480 PolarHBondContact O-ND2 3.08Å; T476-L518 WeakPolarHBondContact OG1-CD1 3.28Å
477	Y	96	Very high	89.9	Confident	43 Å²	43	45.8 Å²	45.8	17%	0.169	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-48.9	175.5	174	-96.9	0	0	0	112	S295 Q296 F451 E473 A474 I475 V479 N480 L481	S295-Y477 VanDerWaalsContact O-CE1 3.24Å; S295-Y477 WeakPolarHBondContact O-CE1 3.46Å; Q296-Y477 HydrophobicContact CB-CE1 4Å; Q296-Y477 HydrophobicContact CB-CE2 4.3Å; Q296-Y477 HydrophobicContact CG-CD2 4.36Å; Q296-Y477 HydrophobicContact CG-CE1 4.31Å; Q296-Y477 HydrophobicContact CG-CE2 3.93Å; F451-Y477 HydrophobicContact CE2-CD1 4.43Å; F451-Y477 AromaticContact CE2-CE1 3.92Å; F451-Y477 HydrophobicContact CE2-CE1 3.92Å; F451-Y477 HydrophobicContact CZ-CD1 4.13Å; F451-Y477 AromaticContact CZ-CE1 3.82Å; F451-Y477 HydrophobicContact CZ-CE1 3.82Å; E473-Y477 WeakPolarHBondContact O-CB 3.39Å; E473-Y477 PolarHBondContact O-N 3.34Å; A474-Y477 PolarHBondContact O-N 2.81Å; I475-Y477 VanDerWaalsContact C-N 3.31Å; I475-Y477 PolarHBondContact O-N 3.46Å; Y477-V479 PolarHBondContact O-N 3.45Å; Y477-N480 PolarHBondContact O-N 2.75Å; Y477-L481 HydrophobicContact CE1-CD2 4.16Å; Y477-L481 WeakPolarHBondContact O-CB 3.36Å; Y477-L481 PolarHBondContact O-N 2.87Å
478	Q	94.8	Very high	87.7	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-45.6	179.3	-68.7	-160	-23.4	0	0	112.6	I294 N450 F451 A474 I475 N480 L481 L482 G494	I294-Q478 HydrophobicContact CG2-CG 4.38Å; I294-Q478 PolarHBondContact O-NE2 3.24Å; N450-Q478 PolarHBondContact O-NE2 2.89Å; F451-Q478 HydrophobicContact CD1-CG 4.38Å; F451-Q478 HydrophobicContact CE1-CB 3.81Å; F451-Q478 HydrophobicContact CE1-CG 3.78Å; F451-Q478 HydrophobicContact CE2-CG 4.06Å; F451-Q478 HydrophobicContact CZ-CB 3.99Å; F451-Q478 HydrophobicContact CZ-CG 3.61Å; A474-Q478 WeakPolarHBondContact O-CG 3.38Å; A474-Q478 PolarHBondContact O-N 2.87Å; I475-Q478 PolarHBondContact O-N 3Å; Q478-N480 PolarHBondContact O-N 2.64Å; Q478-L481 PolarHBondContact O-N 2.8Å; Q478-L482 WeakPolarHBondContact O-CB 3.42Å; Q478-L482 WeakPolarHBondContact O-CD1 3.47Å; Q478-L482 VanDerWaalsContact O-CG 3.25Å; Q478-L482 WeakPolarHBondContact O-CG 3.42Å; Q478-L482 PolarHBondContact O-N 3.3Å; Q478-G494 VanDerWaalsContact OE1-CA 3.25Å
479	V	93.3	Very high	86	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.03	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-49	178.7	176.1	0	0	0	0	110.2	I475 T476 Y477 L482 N483 L518 R522	I475-V479 HydrophobicContact CG2-CG2 4.07Å; I475-V479 WeakPolarHBondContact O-CG2 3.37Å; I475-V479 PolarHBondContact O-N 2.72Å; T476-V479 PolarHBondContact O-N 2.81Å; Y477-V479 PolarHBondContact O-N 3.45Å; V479-L482 PolarHBondContact O-N 3.14Å; V479-N483 WeakPolarHBondContact O-CB 3.39Å; V479-N483 PolarHBondContact O-N 3.5Å; V479-N483 PolarHBondContact O-ND2 3.21Å; V479-L518 HydrophobicContact CB-CD2 4.38Å; V479-L518 HydrophobicContact CG1-CD2 4.2Å; V479-L518 HydrophobicContact CG2-CB 4.1Å; V479-L518 HydrophobicContact CG2-CD2 4.1Å; V479-R522 HydrophobicContact CG2-CG 4.22Å
480	N	93.2	Very high	84.8	Confident	93 Å²	93	57.4 Å²	57.4	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-47	-179	-72	-21.5	0	0	0	111.8	T476 Y477 Q478 L482 N483 V484	T476-N480 WeakPolarHBondContact O-CB 3.47Å; T476-N480 PolarHBondContact O-N 3.4Å; T476-N480 PolarHBondContact O-ND2 3.08Å; Y477-N480 PolarHBondContact O-N 2.75Å; Q478-N480 PolarHBondContact O-N 2.64Å; N480-L482 PolarHBondContact O-N 2.9Å; N480-N483 PolarHBondContact O-N 3.4Å; N480-V484 WeakPolarHBondContact O-CG2 3.27Å; N480-V484 PolarHBondContact O-N 3.21Å
481	L	91.3	Very high	83.9	Confident	26 Å²	26	58.3 Å²	58.3	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-43.9	-179.4	-165.1	68.8	0	0	0	111.4	V448 F451 Y477 Q478 N483 V484 E485 L491	V448-L481 HydrophobicContact CG1-CD2 3.81Å; V448-L481 HydrophobicContact CG2-CD2 4.16Å; F451-L481 HydrophobicContact CE1-CB 4.41Å; F451-L481 HydrophobicContact CE1-CD2 4.12Å; F451-L481 HydrophobicContact CE2-CD2 4.21Å; F451-L481 HydrophobicContact CZ-CB 4.26Å; F451-L481 HydrophobicContact CZ-CD2 3.59Å; Y477-L481 HydrophobicContact CE1-CD2 4.16Å; Y477-L481 WeakPolarHBondContact O-CB 3.36Å; Y477-L481 PolarHBondContact O-N 2.87Å; Q478-L481 PolarHBondContact O-N 2.8Å; L481-N483 VanDerWaalsContact C-N 3.3Å; L481-N483 PolarHBondContact O-N 3.27Å; L481-V484 PolarHBondContact O-N 3.46Å; L481-V484 VanDerWaalsContact O-N 3.12Å; L481-E485 VanDerWaalsContact CD1-CD 3.43Å; L481-E485 HydrophobicContact CD1-CG 4.16Å; L481-E485 WeakPolarHBondContact CD1-OE2 3.19Å; L481-E485 HydrophobicContact CG-CG 4.49Å; L481-E485 VanDerWaalsContact CG-OE2 3.27Å; L481-E485 WeakPolarHBondContact CG-OE2 3.37Å; L481-E485 WeakPolarHBondContact O-CB 3.43Å; L481-E485 PolarHBondContact O-N 2.91Å; L481-L491 HydrophobicContact CD2-CD1 3.94Å; L481-L491 HydrophobicContact CG-CD1 4.34Å
482	L	88.3	Confident	83.3	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-70.5	-24	179.9	-70.3	167.5	0	0	0	113.3	F451 Q478 V479 N480 V484 N486 L491	F451-L482 HydrophobicContact CD1-CD1 3.85Å; F451-L482 HydrophobicContact CD1-CD2 3.99Å; F451-L482 HydrophobicContact CD1-CG 3.96Å; F451-L482 HydrophobicContact CE1-CD1 3.87Å; F451-L482 HydrophobicContact CE1-CD2 4.2Å; F451-L482 HydrophobicContact CE1-CG 3.76Å; Q478-L482 WeakPolarHBondContact O-CB 3.42Å; Q478-L482 WeakPolarHBondContact O-CD1 3.47Å; Q478-L482 VanDerWaalsContact O-CG 3.25Å; Q478-L482 WeakPolarHBondContact O-CG 3.42Å; Q478-L482 PolarHBondContact O-N 3.3Å; V479-L482 PolarHBondContact O-N 3.14Å; N480-L482 PolarHBondContact O-N 2.9Å; L482-V484 VanDerWaalsContact C-N 3.33Å; L482-N486 WeakPolarHBondContact CD2-OD1 3.4Å; L482-N486 WeakPolarHBondContact O-CB 3.28Å; L482-N486 PolarHBondContact O-ND2 3.4Å; L482-L491 HydrophobicContact CD2-CD1 4.39Å
483	N	85.6	Confident	82.9	Confident	104 Å²	104	61.1 Å²	61.1	56%	0.556	35%	0.352	S	S	*	.	H	α-helix	trans	-74.8	-25.9	172.1	-72.4	-19.5	0	0	0	112.2	V479 N480 L481	V479-N483 WeakPolarHBondContact O-CB 3.39Å; V479-N483 PolarHBondContact O-N 3.5Å; V479-N483 PolarHBondContact O-ND2 3.21Å; N480-N483 PolarHBondContact O-N 3.4Å; L481-N483 VanDerWaalsContact C-N 3.3Å; L481-N483 PolarHBondContact O-N 3.27Å
484	V	83.8	Confident	82.7	Confident	123 Å²	123	55.7 Å²	55.7	75%	0.745	33%	0.327	S	S	*	.	H	α-helix	trans	-89.7	-43.6	178.8	178.2	0	0	0	0	111.8	N480 L481 L482	N480-V484 WeakPolarHBondContact O-CG2 3.27Å; N480-V484 PolarHBondContact O-N 3.21Å; L481-V484 PolarHBondContact O-N 3.46Å; L481-V484 VanDerWaalsContact O-N 3.12Å; L482-V484 VanDerWaalsContact C-N 3.33Å
485	E	72.1	Confident	82.6	Confident	54 Å²	54	55.6 Å²	55.6	25%	0.252	33%	0.326	S	S	.	.	H	α-helix	trans	-111.5	-3.5	-161.2	-61.8	-173.8	151.4	0	0	115.7	L481 A487 T488 L489	L481-E485 VanDerWaalsContact CD1-CD 3.43Å; L481-E485 HydrophobicContact CD1-CG 4.16Å; L481-E485 WeakPolarHBondContact CD1-OE2 3.19Å; L481-E485 HydrophobicContact CG-CG 4.49Å; L481-E485 VanDerWaalsContact CG-OE2 3.27Å; L481-E485 WeakPolarHBondContact CG-OE2 3.37Å; L481-E485 WeakPolarHBondContact O-CB 3.43Å; L481-E485 PolarHBondContact O-N 2.91Å; E485-A487 PolarHBondContact O-N 3.48Å; E485-T488 PolarHBondContact O-N 3.34Å; E485-T488 PolarHBondContact O-OG1 3.38Å; E485-T488 VanDerWaalsContact O-OG1 3.05Å; E485-L489 HydrophobicContact CB-CD1 4.18Å; E485-L489 HydrophobicContact CG-CD1 4.37Å; E485-L489 PolarHBondContact O-N 3.09Å; E485-L489 WeakPolarHBondContact OE2-CD1 3.47Å
486	N	59.5	Low	82.4	Confident	79 Å²	79	58.1 Å²	58.1	42%	0.422	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-14.9	-170.5	-110.5	-29.6	0	0	0	115.7	L482	L482-N486 WeakPolarHBondContact CD2-OD1 3.4Å; L482-N486 WeakPolarHBondContact O-CB 3.28Å; L482-N486 PolarHBondContact O-ND2 3.4Å
487	A	49.5	Very low	82.4	Confident	105 Å²	105	58.8 Å²	58.8	87%	0.868	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-17.6	174.3	0	0	0	0	0	113.7	E485	E485-A487 PolarHBondContact O-N 3.48Å
488	T	52.6	Low	82.5	Confident	114 Å²	114	57 Å²	57	70%	0.699	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-19	-166.2	39	0	0	0	0	115.4	E485	E485-T488 PolarHBondContact O-N 3.34Å; E485-T488 PolarHBondContact O-OG1 3.38Å; E485-T488 VanDerWaalsContact O-OG1 3.05Å
489	L	61.8	Low	82.6	Confident	62 Å²	62	59.8 Å²	59.8	33%	0.325	35%	0.351	S	S	.	.			trans	-129.6	123.3	-178.5	-64.2	166.1	0	0	0	110.1	E485 L491	E485-L489 HydrophobicContact CB-CD1 4.18Å; E485-L489 HydrophobicContact CG-CD1 4.37Å; E485-L489 PolarHBondContact O-N 3.09Å; E485-L489 WeakPolarHBondContact OE2-CD1 3.47Å; L489-L491 HydrophobicContact CB-CD1 4.01Å; L489-L491 HydrophobicContact CB-CD2 4.16Å; L489-L491 HydrophobicContact CB-CG 3.63Å; L489-L491 HydrophobicContact CD1-CD1 4.34Å; L489-L491 PolarHBondContact O-N 3.46Å
490	N	73.1	Confident	82.8	Confident	179 Å²	179	59.7 Å²	59.7	96%	0.957	35%	0.35	S	S	*	.			trans	-72.2	56.1	171.2	-73.8	-23.8	0	0	0	110.7	G492	N490-G492 VanDerWaalsContact C-N 3.29Å; N490-G492 PolarHBondContact O-N 3.37Å
491	L	80.1	Confident	83	Confident	34 Å²	34	59.8 Å²	59.8	18%	0.178	35%	0.351	C	S	.	.			trans	-67.2	-31	-175.8	-68.4	168.5	0	0	0	112.3	V448 F451 L481 L482 L489	V448-L491 HydrophobicContact CG1-CD2 4.05Å; F451-L491 CarbonylContact C-O 3.58Å; F451-L491 HydrophobicContact CB-CB 3.95Å; F451-L491 WeakPolarHBondContact CB-O 3.39Å; F451-L491 HydrophobicContact CD1-CB 4.2Å; F451-L491 HydrophobicContact CG-CB 4.16Å; L481-L491 HydrophobicContact CD2-CD1 3.94Å; L481-L491 HydrophobicContact CG-CD1 4.34Å; L482-L491 HydrophobicContact CD2-CD1 4.39Å; L489-L491 HydrophobicContact CB-CD1 4.01Å; L489-L491 HydrophobicContact CB-CD2 4.16Å; L489-L491 HydrophobicContact CB-CG 3.63Å; L489-L491 HydrophobicContact CD1-CD1 4.34Å; L489-L491 PolarHBondContact O-N 3.46Å
492	G	85.8	Confident	83.3	Confident	28 Å²	28	63.7 Å²	63.7	29%	0.289	37%	0.372	S	S	.	.			trans	107.1	-171.7	-168.7	0	0	0	0	0	111.8	F451 N490	F451-G492 CarbonylContact O-C 3.56Å; F451-G492 VanDerWaalsContact O-CA 3.28Å; F451-G492 WeakPolarHBondContact O-CA 3.26Å; N490-G492 VanDerWaalsContact C-N 3.29Å; N490-G492 PolarHBondContact O-N 3.37Å
493	T	88.9	Confident	83.7	Confident	65 Å²	65	64.8 Å²	64.8	40%	0.399	38%	0.378	S	S	.	.			trans	-88.3	-10.7	-175	57.3	0	0	0	0	113.8	F451 L496 R522	F451-T493 PolarHBondContact O-N 3.48Å; T493-L496 HydrophobicContact CG2-CD1 4.49Å; T493-R522 PolarHBondContact O-NH1 2.99Å; T493-R522 PolarHBondContact O-NH2 3.38Å
494	G	93.4	Very high	84.3	Confident	0 Å²	0	63 Å²	63	0%	0	38%	0.378	C	S	.	.			trans	53.7	-167.6	-163.8	0	0	0	0	0	112.6	F451 L453 A454 Q478 L496	F451-G494 WeakPolarHBondContact O-CA 3.07Å; F451-G494 PolarHBondContact O-N 3.26Å; L453-G494 CarbonylContact O-C 3.47Å; A454-G494 WeakPolarHBondContact CA-O 3.33Å; Q478-G494 VanDerWaalsContact OE1-CA 3.25Å; G494-L496 PolarHBondContact O-N 2.9Å
495	I	96.3	Very high	84.8	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	35%	0.347	C	S	.	.			trans	-67.9	124.8	177.7	-59.8	-71.3	0	0	0	109.3	I294 L453 L456 I475 L498 L519 R522	I294-I495 HydrophobicContact CD1-CD1 4.04Å; I294-I495 HydrophobicContact CD1-CG1 4.31Å; I294-I495 HydrophobicContact CG2-CD1 4.38Å; I294-I495 HydrophobicContact CG2-CG1 3.61Å; L453-I495 HydrophobicContact CB-CD1 4.36Å; L453-I495 HydrophobicContact CD2-CD1 4.08Å; L453-I495 HydrophobicContact CG-CD1 4.04Å; L453-I495 WeakPolarHBondContact O-CD1 3.08Å; L453-I495 PolarHBondContact O-N 3.18Å; L456-I495 HydrophobicContact CB-CD1 4Å; I475-I495 HydrophobicContact CD1-CB 3.59Å; I475-I495 HydrophobicContact CD1-CG1 3.95Å; I475-I495 HydrophobicContact CD1-CG2 3.78Å; I495-L498 HydrophobicContact CG2-CB 3.96Å; I495-L519 HydrophobicContact CG2-CD2 3.98Å; I495-L519 WeakPolarHBondContact O-CD2 3.48Å; I495-R522 PolarHBondContact O-NH1 3.11Å
496	L	94.6	Very high	85.9	Confident	57 Å²	57	60.5 Å²	60.5	30%	0.298	36%	0.361	S	S	.	.	S	Bend	trans	-107.8	-30	172.2	-62.7	179.1	0	0	0	111.2	A454 T493 G494 R522	A454-L496 HydrophobicContact CB-CD1 4.47Å; A454-L496 PolarHBondContact O-N 3.2Å; T493-L496 HydrophobicContact CG2-CD1 4.49Å; G494-L496 PolarHBondContact O-N 2.9Å; L496-R522 HydrophobicContact CD2-CB 4.37Å
497	T	96.5	Very high	87.4	Confident	61 Å²	61	61.5 Å²	61.5	37%	0.374	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	122.2	178.3	-53.3	0	0	0	0	109.9	A454 F455 L456 L499	A454-T497 PolarHBondContact O-N 3.18Å; F455-T497 WeakPolarHBondContact CA-O 3.18Å; F455-T497 HydrophobicContact CD2-CG2 3.59Å; F455-T497 HydrophobicContact CE2-CG2 3.65Å; L456-T497 PolarHBondContact N-O 2.85Å; T497-L499 HydrophobicContact CG2-CD2 4.05Å; T497-L499 HydrophobicContact CG2-CG 4.31Å
498	L	97.7	Very high	89.5	Confident	6 Å²	6	63 Å²	63	3%	0.031	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.9	176	-170.9	67	0	0	0	108.2	L456 L458 L471 I475 I495 F500 I515 L519	L456-L498 HydrophobicContact CB-CD1 3.77Å; L456-L498 HydrophobicContact CD2-CD1 3.81Å; L456-L498 HydrophobicContact CG-CD1 3.9Å; L456-L498 WeakPolarHBondContact O-CA 3.35Å; L458-L498 HydrophobicContact CD1-CD1 4.39Å; L471-L498 HydrophobicContact CB-CD2 4.3Å; L471-L498 HydrophobicContact CD1-CD2 4.24Å; L471-L498 HydrophobicContact CD2-CD1 4.43Å; L471-L498 HydrophobicContact CD2-CD2 4.23Å; L471-L498 HydrophobicContact CG-CD2 4.49Å; I475-L498 HydrophobicContact CG1-CD2 4.42Å; I495-L498 HydrophobicContact CG2-CB 3.96Å; L498-F500 HydrophobicContact CB-CD1 4.44Å; L498-F500 HydrophobicContact CD2-CD1 3.91Å; L498-F500 HydrophobicContact CD2-CE1 4.05Å; L498-F500 HydrophobicContact CG-CD1 3.81Å; L498-F500 HydrophobicContact CG-CE1 4.22Å; L498-I515 HydrophobicContact CD2-CG2 4.12Å; L498-L519 HydrophobicContact CB-CD1 3.77Å
499	L	98.1	Very high	91.4	Very high	58 Å²	58	58.7 Å²	58.7	30%	0.304	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.3	175.5	-53.5	-177.6	0	0	0	108.9	F455 L456 N457 L458 S459 T497	F455-L499 HydrophobicContact CE2-CD1 3.98Å; F455-L499 HydrophobicContact CE2-CG 4.27Å; F455-L499 HydrophobicContact CZ-CD1 3.66Å; F455-L499 HydrophobicContact CZ-CG 4.21Å; L456-L499 PolarHBondContact O-N 3.41Å; N457-L499 HydrophobicContact CB-CB 4.2Å; N457-L499 HydrophobicContact CB-CD1 4.31Å; N457-L499 WeakPolarHBondContact OD1-CB 3.49Å; L458-L499 WeakPolarHBondContact CA-O 3.47Å; L458-L499 PolarHBondContact N-O 3.31Å; S459-L499 PolarHBondContact N-O 3.19Å; S459-L499 WeakPolarHBondContact OG-CB 3.47Å; T497-L499 HydrophobicContact CG2-CD2 4.05Å; T497-L499 HydrophobicContact CG2-CG 4.31Å
500	F	97.3	Very high	93	Very high	4 Å²	4	63.7 Å²	63.7	2%	0.018	36%	0.361	C	S	.	.			trans	-144.5	23.3	-177.7	51.6	-95.4	0	0	0	112.1	L468 L498 N503 F505 I512 I515 H516	L468-F500 HydrophobicContact CD1-CD2 4.4Å; L468-F500 HydrophobicContact CD1-CE2 4.25Å; L498-F500 HydrophobicContact CB-CD1 4.44Å; L498-F500 HydrophobicContact CD2-CD1 3.91Å; L498-F500 HydrophobicContact CD2-CE1 4.05Å; L498-F500 HydrophobicContact CG-CD1 3.81Å; L498-F500 HydrophobicContact CG-CE1 4.22Å; F500-N503 PolarHBondContact O-ND2 2.93Å; F500-F505 HydrophobicContact CB-CZ 4.32Å; F500-F505 AromaticContact CD2-CE2 3.97Å; F500-F505 HydrophobicContact CD2-CE2 3.97Å; F500-F505 AromaticContact CD2-CZ 3.61Å; F500-F505 HydrophobicContact CD2-CZ 3.61Å; F500-F505 HydrophobicContact CE2-CE2 4.45Å; F500-F505 HydrophobicContact CE2-CZ 4.43Å; F500-F505 HydrophobicContact CG-CZ 4.35Å; F500-F505 WeakPolarHBondContact O-CZ 3.42Å; F500-I512 HydrophobicContact CE2-CB 4.22Å; F500-I512 HydrophobicContact CE2-CD1 4.32Å; F500-I512 HydrophobicContact CE2-CG1 3.85Å; F500-I512 HydrophobicContact CE2-CG2 3.75Å; F500-I512 HydrophobicContact CZ-CB 4.5Å; F500-I512 HydrophobicContact CZ-CG2 3.95Å; F500-I515 HydrophobicContact CE1-CG2 3.9Å; F500-I515 HydrophobicContact CZ-CD1 4.48Å; F500-I515 HydrophobicContact CZ-CG2 4.24Å; F500-H516 AromaticContact CZ-CE1 3.95Å; F500-H516 AromaticContact CZ-NE2 3.81Å
501	D	96.4	Very high	94.2	Very high	94 Å²	94	57 Å²	57	50%	0.503	32%	0.324	S	S	.	.			trans	-61.7	160.4	178.3	-54.8	-54.3	0	0	0	111.4	S459 R460 N503	S459-D501 CarbonylContact C-O 3.58Å; S459-D501 WeakPolarHBondContact CA-O 3.28Å; S459-D501 VanDerWaalsContact CB-O 3.31Å; S459-D501 WeakPolarHBondContact CB-O 3.41Å; S459-D501 PolarHBondContact OG-N 3.16Å; R460-D501 PolarHBondContact N-O 3.2Å; D501-N503 PolarHBondContact O-ND2 3.21Å
502	D	97.1	Very high	95	Very high	109 Å²	109	56.3 Å²	56.3	58%	0.583	32%	0.32	S	S	*	.	S	Bend	trans	55.4	52.4	177.9	-56.9	-33.3	0	0	0	113.4	R460 N461	R460-D502 CarbonylContact C-O 3.6Å; R460-D502 WeakPolarHBondContact CA-O 3.41Å; R460-D502 HydrophobicContact CB-CB 4.33Å; R460-D502 HydrophobicContact CG-CB 3.61Å; R460-D502 WeakPolarHBondContact CG-OD2 3.27Å; R460-D502 PolarHBondContact N-O 2.92Å; R460-D502 IonicContact NE-OD2 2.84Å; R460-D502 PolarHBondContact NE-OD2 3.23Å; N461-D502 PolarHBondContact N-O 2.95Å
503	N	98.1	Very high	95.4	Very high	25 Å²	25	58.6 Å²	58.6	13%	0.134	33%	0.329	C	S	.	.	S	Bend	trans	-119.9	179.4	176.7	-89	-76.1	0	0	0	112.2	L458 N461 S462 I463 F500 D501 F505	L458-N503 PolarHBondContact O-ND2 2.95Å; L458-N503 VanDerWaalsContact O-ND2 3.08Å; N461-N503 VanDerWaalsContact CA-OD1 3.28Å; N461-N503 WeakPolarHBondContact CA-OD1 3.4Å; N461-N503 WeakPolarHBondContact CB-OD1 3.43Å; N461-N503 PolarHBondContact N-OD1 3Å; N461-N503 PolarHBondContact O-OD1 3.45Å; S462-N503 PolarHBondContact N-OD1 2.9Å; I463-N503 HydrophobicContact CB-CB 4.29Å; I463-N503 VanDerWaalsContact CB-OD1 3.26Å; I463-N503 WeakPolarHBondContact CB-OD1 3.24Å; I463-N503 WeakPolarHBondContact CG1-OD1 3.26Å; I463-N503 PolarHBondContact N-OD1 3.39Å; F500-N503 PolarHBondContact O-ND2 2.93Å; D501-N503 PolarHBondContact O-ND2 3.21Å; N503-F505 VanDerWaalsContact C-N 3.29Å; N503-F505 HydrophobicContact CB-CD1 4.01Å; N503-F505 HydrophobicContact CB-CE1 3.39Å; N503-F505 HydrophobicContact CB-CE2 4.29Å; N503-F505 HydrophobicContact CB-CZ 3.54Å; N503-F505 PolarHBondContact O-N 3.49Å
504	A	97.2	Very high	95.9	Very high	67 Å²	67	57.7 Å²	57.7	55%	0.554	33%	0.325	S	S	*	.	S	Bend	trans	-88.7	35.7	-173.6	0	0	0	0	0	114.1	I463	I463-A504 CarbonylContact O-C 3.48Å; I463-A504 VanDerWaalsContact O-CA 3.28Å; I463-A504 WeakPolarHBondContact O-CA 3.36Å; I463-A504 WeakPolarHBondContact O-CB 3.24Å; I463-A504 PolarHBondContact O-N 3.45Å
505	F	95.6	Very high	96	Very high	25 Å²	25	57.7 Å²	57.7	11%	0.11	33%	0.325	C	S	.	.	S	Bend	trans	-126.4	160.9	170.9	46.7	-106	0	0	0	110.6	I463 L468 F500 N503 I512	I463-F505 HydrophobicContact CB-CE1 4.3Å; I463-F505 HydrophobicContact CG2-CE1 4.22Å; I463-F505 WeakPolarHBondContact O-CD1 3.32Å; L468-F505 HydrophobicContact CB-CD1 4.07Å; L468-F505 HydrophobicContact CB-CE1 4.26Å; L468-F505 HydrophobicContact CD1-CE1 4.41Å; L468-F505 HydrophobicContact CD1-CZ 4.31Å; L468-F505 HydrophobicContact CD2-CD1 4.33Å; L468-F505 HydrophobicContact CD2-CD2 4.08Å; L468-F505 HydrophobicContact CD2-CE2 4.41Å; L468-F505 HydrophobicContact CD2-CG 4.05Å; F500-F505 HydrophobicContact CB-CZ 4.32Å; F500-F505 AromaticContact CD2-CE2 3.97Å; F500-F505 HydrophobicContact CD2-CE2 3.97Å; F500-F505 AromaticContact CD2-CZ 3.61Å; F500-F505 HydrophobicContact CD2-CZ 3.61Å; F500-F505 HydrophobicContact CE2-CE2 4.45Å; F500-F505 HydrophobicContact CE2-CZ 4.43Å; F500-F505 HydrophobicContact CG-CZ 4.35Å; F500-F505 WeakPolarHBondContact O-CZ 3.42Å; N503-F505 VanDerWaalsContact C-N 3.29Å; N503-F505 HydrophobicContact CB-CD1 4.01Å; N503-F505 HydrophobicContact CB-CE1 3.39Å; N503-F505 HydrophobicContact CB-CE2 4.29Å; N503-F505 HydrophobicContact CB-CZ 3.54Å; N503-F505 PolarHBondContact O-N 3.49Å; F505-I512 HydrophobicContact CD2-CD1 3.84Å; F505-I512 HydrophobicContact CE2-CD1 3.72Å; F505-I512 HydrophobicContact CE2-CG1 4.36Å
506	N	94.5	Very high	96	Very high	99 Å²	99	62 Å²	62	53%	0.529	35%	0.345	S	S	.	.			trans	-64	125.2	177.6	-176	-6.7	0	0	0	110	D508 C509	N506-D508 PolarHBondContact O-N 2.96Å; N506-D508 PolarHBondContact OD1-N 3.28Å; N506-C509 WeakPolarHBondContact O-CB 3.49Å; N506-C509 PolarHBondContact O-N 2.98Å; N506-C509 VanDerWaalsContact O-N 3.11Å
507	P	91.7	Very high	96	Very high	99 Å²	99	65.4 Å²	65.4	64%	0.643	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21	176.3	24.7	-35.8	0	0	0	114.1	C509 I512	P507-C509 VanDerWaalsContact C-N 3.3Å; P507-C509 PolarHBondContact O-N 3.46Å; P507-I512 WeakPolarHBondContact O-CD1 3.26Å
508	D	92.1	Very high	96	Very high	137 Å²	137	64.4 Å²	64.4	73%	0.733	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	14.5	177.7	-58.4	-40.8	0	0	0	113.1	N506 E510	N506-D508 PolarHBondContact O-N 2.96Å; N506-D508 PolarHBondContact OD1-N 3.28Å; D508-E510 PolarHBondContact O-N 3.46Å
509	C	93.8	Very high	95.8	Very high	24 Å²	24	64.8 Å²	64.8	16%	0.162	35%	0.354	C	S	.	.			trans	-68.5	128.1	-179.1	-176.2	0	0	0	0	111.8	L468 N506 P507 M511 I512	L468-C509 HydrophobicContact CD2-CB 4.28Å; N506-C509 WeakPolarHBondContact O-CB 3.49Å; N506-C509 PolarHBondContact O-N 2.98Å; N506-C509 VanDerWaalsContact O-N 3.11Å; P507-C509 VanDerWaalsContact C-N 3.3Å; P507-C509 PolarHBondContact O-N 3.46Å; C509-M511 PolarHBondContact O-N 3.18Å; C509-I512 HydrophobicContact CB-CD1 4.14Å; C509-I512 HydrophobicContact CB-CG1 4.21Å; C509-I512 VanDerWaalsContact O-CB 3.28Å; C509-I512 WeakPolarHBondContact O-CB 3.21Å; C509-I512 PolarHBondContact O-N 2.74Å
510	E	95.9	Very high	95.6	Very high	166 Å²	166	64.8 Å²	64.8	78%	0.776	36%	0.362	S	S	*	.	H	α-helix	trans	-55.7	-26.5	179.2	-64.2	-180	173.2	0	0	114.1	D508 I512 T513 S514	D508-E510 PolarHBondContact O-N 3.46Å; E510-I512 VanDerWaalsContact C-N 3.27Å; E510-I512 PolarHBondContact O-N 2.92Å; E510-T513 PolarHBondContact O-N 3.38Å; E510-S514 PolarHBondContact O-N 2.71Å; E510-S514 PolarHBondContact O-OG 3.47Å
511	M	96.9	Very high	95.2	Very high	39 Å²	39	67.6 Å²	67.6	19%	0.192	38%	0.382	C	S	.	.	H	α-helix	trans	-64.6	-31	175.3	-68.2	-167.1	-76.8	0	0	112.4	I465 L468 K469 L472 C509 S514 I515	I465-M511 HydrophobicContact CD1-CE 3.14Å; I465-M511 HydrophobicContact CG1-CE 3.6Å; L468-M511 HydrophobicContact CD2-CB 3.99Å; L468-M511 HydrophobicContact CD2-CE 4.21Å; L468-M511 HydrophobicContact CG-CB 4.14Å; L468-M511 HydrophobicContact CG-CE 4.42Å; K469-M511 HydrophobicContact CB-CE 4.4Å; K469-M511 HydrophobicContact CB-SD 4Å; K469-M511 HydrophobicContact CG-SD 4.36Å; L472-M511 HydrophobicContact CD2-CB 4.03Å; L472-M511 HydrophobicContact CD2-CG 3.74Å; L472-M511 HydrophobicContact CD2-SD 4.06Å; C509-M511 PolarHBondContact O-N 3.18Å; M511-S514 PolarHBondContact O-N 3.25Å; M511-I515 VanDerWaalsContact O-CG1 3.29Å; M511-I515 WeakPolarHBondContact O-CG1 3.28Å; M511-I515 PolarHBondContact O-N 3.5Å
512	I	96.5	Very high	94.7	Very high	19 Å²	19	64.1 Å²	64.1	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-64.7	-49.4	175.9	-62.6	176.5	0	0	0	109.6	L468 F500 F505 P507 C509 E510 S514 I515 H516	L468-I512 HydrophobicContact CD1-CG1 4.25Å; L468-I512 HydrophobicContact CD2-CD1 4.43Å; L468-I512 HydrophobicContact CD2-CG1 3.78Å; F500-I512 HydrophobicContact CE2-CB 4.22Å; F500-I512 HydrophobicContact CE2-CD1 4.32Å; F500-I512 HydrophobicContact CE2-CG1 3.85Å; F500-I512 HydrophobicContact CE2-CG2 3.75Å; F500-I512 HydrophobicContact CZ-CB 4.5Å; F500-I512 HydrophobicContact CZ-CG2 3.95Å; F505-I512 HydrophobicContact CD2-CD1 3.84Å; F505-I512 HydrophobicContact CE2-CD1 3.72Å; F505-I512 HydrophobicContact CE2-CG1 4.36Å; P507-I512 WeakPolarHBondContact O-CD1 3.26Å; C509-I512 HydrophobicContact CB-CD1 4.14Å; C509-I512 HydrophobicContact CB-CG1 4.21Å; C509-I512 VanDerWaalsContact O-CB 3.28Å; C509-I512 WeakPolarHBondContact O-CB 3.21Å; C509-I512 PolarHBondContact O-N 2.74Å; E510-I512 VanDerWaalsContact C-N 3.27Å; E510-I512 PolarHBondContact O-N 2.92Å; I512-S514 VanDerWaalsContact C-N 3.31Å; I512-S514 PolarHBondContact O-N 2.98Å; I512-I515 PolarHBondContact O-N 3.14Å; I512-H516 PolarHBondContact O-CD2 2.99Å; I512-H516 PolarHBondContact O-N 3.24Å
513	T	96	Very high	93.7	Very high	76 Å²	76	62.1 Å²	62.1	47%	0.466	35%	0.351	S	S	.	.	H	α-helix	trans	-57.1	-46.5	175.2	-49.2	0	0	0	0	111	E510 I515 H516 E517	E510-T513 PolarHBondContact O-N 3.38Å; T513-I515 PolarHBondContact O-N 3.27Å; T513-H516 PolarHBondContact O-N 3.46Å; T513-E517 HydrophobicContact CG2-CG 4.47Å; T513-E517 WeakPolarHBondContact O-CG 3.34Å; T513-E517 PolarHBondContact O-N 3.4Å
514	S	97.4	Very high	92.5	Very high	46 Å²	46	65 Å²	65	32%	0.322	37%	0.371	S	S	.	.	H	α-helix	trans	-59.5	-43.1	178	-57.3	0	0	0	0	112.3	E510 M511 I512 L518	E510-S514 PolarHBondContact O-N 2.71Å; E510-S514 PolarHBondContact O-OG 3.47Å; M511-S514 PolarHBondContact O-N 3.25Å; I512-S514 VanDerWaalsContact C-N 3.31Å; I512-S514 PolarHBondContact O-N 2.98Å; S514-L518 WeakPolarHBondContact O-CB 3.17Å; S514-L518 VanDerWaalsContact O-CG 3.24Å; S514-L518 WeakPolarHBondContact O-CG 3.45Å; S514-L518 PolarHBondContact O-N 2.78Å
515	I	97.3	Very high	91.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-46.8	175.8	-71.2	169.3	0	0	0	110.6	L468 L471 L472 L498 F500 M511 I512 T513 L518 L519	L468-I515 HydrophobicContact CD1-CD1 3.58Å; L468-I515 HydrophobicContact CG-CD1 4.45Å; L471-I515 HydrophobicContact CB-CD1 4.24Å; L472-I515 HydrophobicContact CB-CD1 4.09Å; L472-I515 HydrophobicContact CB-CG1 3.93Å; L472-I515 HydrophobicContact CD1-CG1 3.83Å; L472-I515 HydrophobicContact CG-CG1 4.47Å; L498-I515 HydrophobicContact CD2-CG2 4.12Å; F500-I515 HydrophobicContact CE1-CG2 3.9Å; F500-I515 HydrophobicContact CZ-CD1 4.48Å; F500-I515 HydrophobicContact CZ-CG2 4.24Å; M511-I515 VanDerWaalsContact O-CG1 3.29Å; M511-I515 WeakPolarHBondContact O-CG1 3.28Å; M511-I515 PolarHBondContact O-N 3.5Å; I512-I515 PolarHBondContact O-N 3.14Å; T513-I515 PolarHBondContact O-N 3.27Å; I515-L518 PolarHBondContact O-N 3.43Å; I515-L519 HydrophobicContact CG2-CD1 3.89Å; I515-L519 HydrophobicContact CG2-CG 4.39Å; I515-L519 WeakPolarHBondContact O-CG 3.21Å; I515-L519 PolarHBondContact O-N 2.99Å
516	H	95.3	Very high	89.4	Confident	90 Å²	90	66.2 Å²	66.2	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-41.2	179.9	-72.1	-51.3	0	0	0	112.5	F500 I512 T513 L519 A520	F500-H516 AromaticContact CZ-CE1 3.95Å; F500-H516 AromaticContact CZ-NE2 3.81Å; I512-H516 PolarHBondContact O-CD2 2.99Å; I512-H516 PolarHBondContact O-N 3.24Å; T513-H516 PolarHBondContact O-N 3.46Å; H516-L519 PolarHBondContact O-N 3.09Å; H516-A520 VanDerWaalsContact O-CB 3.23Å; H516-A520 WeakPolarHBondContact O-CB 3.32Å; H516-A520 PolarHBondContact O-N 2.89Å
517	E	95.5	Very high	87.4	Confident	129 Å²	129	67.4 Å²	67.4	60%	0.603	38%	0.375	S	S	*	.	H	α-helix	trans	-62.4	-45.5	175	-73.7	177.6	-179.4	0	0	111.8	T513 L519 A520 S521	T513-E517 HydrophobicContact CG2-CG 4.47Å; T513-E517 WeakPolarHBondContact O-CG 3.34Å; T513-E517 PolarHBondContact O-N 3.4Å; E517-L519 PolarHBondContact O-N 2.95Å; E517-A520 PolarHBondContact O-N 3.4Å; E517-S521 PolarHBondContact O-N 3.04Å
518	L	95.8	Very high	85.5	Confident	40 Å²	40	67.6 Å²	67.6	21%	0.209	37%	0.369	C	S	.	.	H	α-helix	trans	-59.9	-45.1	175.8	-74.5	171.5	0	0	0	111.5	L472 I475 T476 V479 S514 I515 S521 R522	L472-L518 HydrophobicContact CD1-CD1 3.74Å; I475-L518 HydrophobicContact CG2-CB 3.84Å; I475-L518 HydrophobicContact CG2-CD1 4.18Å; T476-L518 WeakPolarHBondContact OG1-CD1 3.28Å; V479-L518 HydrophobicContact CB-CD2 4.38Å; V479-L518 HydrophobicContact CG1-CD2 4.2Å; V479-L518 HydrophobicContact CG2-CB 4.1Å; V479-L518 HydrophobicContact CG2-CD2 4.1Å; S514-L518 WeakPolarHBondContact O-CB 3.17Å; S514-L518 VanDerWaalsContact O-CG 3.24Å; S514-L518 WeakPolarHBondContact O-CG 3.45Å; S514-L518 PolarHBondContact O-N 2.78Å; I515-L518 PolarHBondContact O-N 3.43Å; L518-S521 PolarHBondContact O-N 2.8Å; L518-S521 PolarHBondContact O-OG 3.35Å; L518-R522 WeakPolarHBondContact O-CG 3.29Å
519	L	94.4	Very high	83.6	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-68.4	-40.7	178	-68.4	175.2	0	0	0	112.4	I475 I495 L498 I515 H516 E517 S521 R522 D523	I475-L519 HydrophobicContact CD1-CD2 4.19Å; I475-L519 HydrophobicContact CG2-CD2 4Å; I475-L519 HydrophobicContact CG2-CG 4.3Å; I495-L519 HydrophobicContact CG2-CD2 3.98Å; I495-L519 WeakPolarHBondContact O-CD2 3.48Å; L498-L519 HydrophobicContact CB-CD1 3.77Å; I515-L519 HydrophobicContact CG2-CD1 3.89Å; I515-L519 HydrophobicContact CG2-CG 4.39Å; I515-L519 WeakPolarHBondContact O-CG 3.21Å; I515-L519 PolarHBondContact O-N 2.99Å; H516-L519 PolarHBondContact O-N 3.09Å; E517-L519 PolarHBondContact O-N 2.95Å; L519-S521 VanDerWaalsContact C-N 3.28Å; L519-S521 PolarHBondContact O-N 3.2Å; L519-R522 WeakPolarHBondContact O-CA 3.34Å; L519-R522 WeakPolarHBondContact O-CB 3.48Å; L519-R522 PolarHBondContact O-N 3.41Å; L519-D523 PolarHBondContact O-N 3.19Å
520	A	92.2	Very high	81.4	Confident	57 Å²	57	68.8 Å²	68.8	47%	0.471	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-35.4	176.9	0	0	0	0	0	112.1	H516 E517 R522 D523	H516-A520 VanDerWaalsContact O-CB 3.23Å; H516-A520 WeakPolarHBondContact O-CB 3.32Å; H516-A520 PolarHBondContact O-N 2.89Å; E517-A520 PolarHBondContact O-N 3.4Å; A520-R522 PolarHBondContact O-N 3.44Å; A520-R522 VanDerWaalsContact O-N 3.08Å; A520-D523 WeakPolarHBondContact O-CB 3.45Å; A520-D523 PolarHBondContact O-N 3Å; A520-D523 VanDerWaalsContact O-N 3.12Å
521	S	88.8	Confident	79.1	Confident	63 Å²	63	65.6 Å²	65.6	44%	0.441	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.9	173.6	82.1	0	0	0	0	113.6	E517 L518 L519	E517-S521 PolarHBondContact O-N 3.04Å; L518-S521 PolarHBondContact O-N 2.8Å; L518-S521 PolarHBondContact O-OG 3.35Å; L519-S521 VanDerWaalsContact C-N 3.28Å; L519-S521 PolarHBondContact O-N 3.2Å
522	R	86.2	Confident	77	Confident	21 Å²	21	67.9 Å²	67.9	8%	0.079	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-3.1	-178.9	-55.6	-165.4	68	-126.5	-29.6	113.6	V479 T493 I495 L496 L518 L519 A520 P524	V479-R522 HydrophobicContact CG2-CG 4.22Å; T493-R522 PolarHBondContact O-NH1 2.99Å; T493-R522 PolarHBondContact O-NH2 3.38Å; I495-R522 PolarHBondContact O-NH1 3.11Å; L496-R522 HydrophobicContact CD2-CB 4.37Å; L518-R522 WeakPolarHBondContact O-CG 3.29Å; L519-R522 WeakPolarHBondContact O-CA 3.34Å; L519-R522 WeakPolarHBondContact O-CB 3.48Å; L519-R522 PolarHBondContact O-N 3.41Å; A520-R522 PolarHBondContact O-N 3.44Å; A520-R522 VanDerWaalsContact O-N 3.08Å; R522-P524 WeakPolarHBondContact O-CD 3.32Å
523	D	76.8	Confident	75	Confident	67 Å²	67	73.3 Å²	73.3	36%	0.358	40%	0.397	S	S	.	.			trans	-63.4	121.2	177.5	-169.9	-27.6	0	0	0	109.8	L519 A520 T525 A526	L519-D523 PolarHBondContact O-N 3.19Å; A520-D523 WeakPolarHBondContact O-CB 3.45Å; A520-D523 PolarHBondContact O-N 3Å; A520-D523 VanDerWaalsContact O-N 3.12Å; D523-T525 PolarHBondContact O-N 3.49Å; D523-T525 VanDerWaalsContact O-N 3.14Å; D523-T525 WeakPolarHBondContact OD1-CB 3.34Å; D523-T525 PolarHBondContact OD1-N 3.25Å; D523-T525 PolarHBondContact OD1-OG1 3.32Å; D523-T525 PolarHBondContact OD2-OG1 2.95Å; D523-A526 HydrophobicContact CB-CB 4.01Å; D523-A526 PolarHBondContact O-N 3.27Å; D523-A526 VanDerWaalsContact O-N 3.1Å
524	P	72.4	Confident	73	Confident	85 Å²	85	74 Å²	74	55%	0.552	40%	0.397	S	S	*	.	H	α-helix	trans	-54.7	-31.1	176.1	-24.6	33.7	0	0	0	112.9	R522	R522-P524 WeakPolarHBondContact O-CD 3.32Å
525	T	70.4	Confident	70.8	Confident	83 Å²	83	76.2 Å²	76.2	51%	0.509	41%	0.405	S	S	.	.	H	α-helix	trans	-75.2	-32.3	-179.5	68	0	0	0	0	112.5	D523 R527 I528	D523-T525 PolarHBondContact O-N 3.49Å; D523-T525 VanDerWaalsContact O-N 3.14Å; D523-T525 WeakPolarHBondContact OD1-CB 3.34Å; D523-T525 PolarHBondContact OD1-N 3.25Å; D523-T525 PolarHBondContact OD1-OG1 3.32Å; D523-T525 PolarHBondContact OD2-OG1 2.95Å; T525-R527 VanDerWaalsContact C-N 3.32Å; T525-R527 PolarHBondContact O-N 2.89Å; T525-I528 PolarHBondContact O-N 3.23Å
526	A	57.9	Low	68.8	Low	36 Å²	36	81.4 Å²	81.4	30%	0.298	43%	0.433	S	S	.	.	H	α-helix	trans	-67.1	-32.6	177.8	0	0	0	0	0	112.4	D523 I529 N530	D523-A526 HydrophobicContact CB-CB 4.01Å; D523-A526 PolarHBondContact O-N 3.27Å; D523-A526 VanDerWaalsContact O-N 3.1Å; A526-I529 PolarHBondContact O-N 3.47Å; A526-N530 PolarHBondContact O-N 2.95Å
527	R	51.3	Low	66.9	Low	124 Å²	124	79.6 Å²	79.6	47%	0.468	43%	0.43	S	S	.	.	H	α-helix	trans	-67.4	-33.1	176.6	-70.4	-174.3	-177.3	-171.8	-2	113.2	T525 N531	T525-R527 VanDerWaalsContact C-N 3.32Å; T525-R527 PolarHBondContact O-N 2.89Å; R527-N531 PolarHBondContact O-N 3.3Å
528	I	53.1	Low	64.8	Low	102 Å²	102	79.5 Å²	79.5	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-66.2	-42.9	179.4	-62.4	171.8	0	0	0	109.9	T525 N530 N531 D532	T525-I528 PolarHBondContact O-N 3.23Å; I528-N530 VanDerWaalsContact C-N 3.34Å; I528-N530 PolarHBondContact O-N 3.21Å; I528-N531 PolarHBondContact O-N 3.5Å; I528-D532 PolarHBondContact O-N 2.83Å
529	I	51.6	Low	62.8	Low	93 Å²	93	82.9 Å²	82.9	48%	0.477	45%	0.448	S	S	.	.	H	α-helix	trans	-65.3	-37	-178.4	-59.3	169.7	0	0	0	111.9	A526 K533	A526-I529 PolarHBondContact O-N 3.47Å; I529-K533 HydrophobicContact CG2-CD 4.39Å; I529-K533 WeakPolarHBondContact O-CB 3.27Å; I529-K533 WeakPolarHBondContact O-CG 3.44Å; I529-K533 PolarHBondContact O-N 3.29Å
530	N	47.5	Very low	61	Low	94 Å²	94	85.6 Å²	85.6	50%	0.503	47%	0.468	S	S	.	.	H	α-helix	trans	-73.4	-34.5	178.1	-76.3	-17.8	0	0	0	112.5	A526 I528 I534	A526-N530 PolarHBondContact O-N 2.95Å; I528-N530 VanDerWaalsContact C-N 3.34Å; I528-N530 PolarHBondContact O-N 3.21Å; N530-I534 WeakPolarHBondContact O-CD1 3.44Å; N530-I534 VanDerWaalsContact O-CG1 3.24Å; N530-I534 WeakPolarHBondContact O-CG1 3.16Å; N530-I534 PolarHBondContact O-N 3.35Å; N530-I534 VanDerWaalsContact O-N 3.1Å
531	N	48.2	Very low	59.2	Low	99 Å²	99	89.7 Å²	89.7	53%	0.529	48%	0.482	S	S	.	.	H	α-helix	trans	-69.3	-39.5	173.9	-76.3	-11.8	0	0	0	111.8	R527 I528 I534 L535	R527-N531 PolarHBondContact O-N 3.3Å; I528-N531 PolarHBondContact O-N 3.5Å; N531-I534 PolarHBondContact O-N 2.87Å; N531-L535 WeakPolarHBondContact O-CB 3.32Å; N531-L535 PolarHBondContact O-N 2.8Å
532	D	53.2	Low	57.4	Low	86 Å²	86	90 Å²	90	46%	0.46	48%	0.484	S	S	.	.	H	α-helix	trans	-65.8	-39.9	176.1	-72.4	-19.9	0	0	0	111.6	I528 I534 L535 D536	I528-D532 PolarHBondContact O-N 2.83Å; D532-I534 VanDerWaalsContact C-N 3.34Å; D532-I534 PolarHBondContact O-N 2.96Å; D532-L535 PolarHBondContact O-N 3.14Å; D532-D536 WeakPolarHBondContact O-CB 3.1Å; D532-D536 PolarHBondContact O-N 3.42Å
533	K	54	Low	55.4	Low	134 Å²	134	96.2 Å²	96.2	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-64.1	-36	174	-76.4	179	-179.4	179.5	0	113.2	I529 S537	I529-K533 HydrophobicContact CG2-CD 4.39Å; I529-K533 WeakPolarHBondContact O-CB 3.27Å; I529-K533 WeakPolarHBondContact O-CG 3.44Å; I529-K533 PolarHBondContact O-N 3.29Å; K533-S537 WeakPolarHBondContact O-CB 3.38Å; K533-S537 PolarHBondContact O-N 2.83Å; K533-S537 PolarHBondContact O-OG 2.79Å
534	I	53.5	Low	53.8	Low	89 Å²	89	98.9 Å²	98.9	46%	0.456	54%	0.537	S	S	.	.	H	α-helix	trans	-68.6	-45.2	175.7	-68.7	165.3	0	0	0	109.7	N530 N531 D532 D536 S537 E538	N530-I534 WeakPolarHBondContact O-CD1 3.44Å; N530-I534 VanDerWaalsContact O-CG1 3.24Å; N530-I534 WeakPolarHBondContact O-CG1 3.16Å; N530-I534 PolarHBondContact O-N 3.35Å; N530-I534 VanDerWaalsContact O-N 3.1Å; N531-I534 PolarHBondContact O-N 2.87Å; D532-I534 VanDerWaalsContact C-N 3.34Å; D532-I534 PolarHBondContact O-N 2.96Å; I534-D536 PolarHBondContact O-N 2.86Å; I534-S537 PolarHBondContact O-N 3.19Å; I534-S537 PolarHBondContact O-OG 2.98Å; I534-E538 HydrophobicContact CG2-CG 4.45Å; I534-E538 WeakPolarHBondContact O-CG 3.44Å; I534-E538 PolarHBondContact O-N 3.42Å
535	L	51.8	Low	52.3	Low	93 Å²	93	104.7 Å²	104.7	49%	0.487	55%	0.554	S	S	.	*	H	α-helix	trans	-60	-41.9	175	-93.6	139.5	0	0	0	112.5	N531 D532 E538 L539	N531-L535 WeakPolarHBondContact O-CB 3.32Å; N531-L535 PolarHBondContact O-N 2.8Å; D532-L535 PolarHBondContact O-N 3.14Å; L535-E538 PolarHBondContact O-N 2.94Å; L535-L539 WeakPolarHBondContact O-CB 3.39Å; L535-L539 WeakPolarHBondContact O-CD1 3.31Å; L535-L539 VanDerWaalsContact O-CG 3.24Å; L535-L539 WeakPolarHBondContact O-CG 3.4Å; L535-L539 PolarHBondContact O-N 3.41Å
536	D	54	Low	50.9	Low	110 Å²	110	112.3 Å²	112.3	59%	0.588	59%	0.59	S	S	*	*	H	α-helix	trans	-68.1	-33.8	175.9	-73.9	-21.5	0	0	0	112.3	D532 I534 S540	D532-D536 WeakPolarHBondContact O-CB 3.1Å; D532-D536 PolarHBondContact O-N 3.42Å; I534-D536 PolarHBondContact O-N 2.86Å; D536-S540 WeakPolarHBondContact O-CB 3.2Å; D536-S540 PolarHBondContact O-N 2.82Å; D536-S540 PolarHBondContact O-OG 3.35Å
537	S	56	Low	50.6	Low	52 Å²	52	116.2 Å²	116.2	36%	0.364	61%	0.605	S	S	.	*	H	α-helix	trans	-73.2	-32.9	175.1	76.7	0	0	0	0	113.2	K533 I534 S540 N541	K533-S537 WeakPolarHBondContact O-CB 3.38Å; K533-S537 PolarHBondContact O-N 2.83Å; K533-S537 PolarHBondContact O-OG 2.79Å; I534-S537 PolarHBondContact O-N 3.19Å; I534-S537 PolarHBondContact O-OG 2.98Å; S537-S540 WeakPolarHBondContact CA-OG 3.3Å; S537-S540 PolarHBondContact O-OG 3.26Å; S537-S540 VanDerWaalsContact O-OG 3.12Å; S537-N541 WeakPolarHBondContact O-CB 3.41Å; S537-N541 PolarHBondContact O-N 2.59Å; S537-N541 PolarHBondContact O-ND2 3.21Å
538	E	52	Low	50.5	Low	126 Å²	126	115.7 Å²	115.7	59%	0.589	61%	0.612	S	S	*	*	H	α-helix	trans	-76.9	-34.3	175.4	-73.5	-172.7	166	0	0	111.9	I534 L535 S542	I534-E538 HydrophobicContact CG2-CG 4.45Å; I534-E538 WeakPolarHBondContact O-CG 3.44Å; I534-E538 PolarHBondContact O-N 3.42Å; L535-E538 PolarHBondContact O-N 2.94Å; E538-S542 WeakPolarHBondContact O-CB 3.49Å; E538-S542 PolarHBondContact O-N 2.95Å; E538-S542 PolarHBondContact O-OG 2.7Å
539	L	54.5	Low	50.4	Low	112 Å²	112	116.5 Å²	116.5	59%	0.586	62%	0.617	S	S	*	*	H	α-helix	trans	-71.5	-32.6	174	-74	165.2	0	0	0	112.5	L535 S542	L535-L539 WeakPolarHBondContact O-CB 3.39Å; L535-L539 WeakPolarHBondContact O-CD1 3.31Å; L535-L539 VanDerWaalsContact O-CG 3.24Å; L535-L539 WeakPolarHBondContact O-CG 3.4Å; L535-L539 PolarHBondContact O-N 3.41Å; L539-S542 PolarHBondContact O-OG 3.23Å
540	S	56.2	Low	50.3	Low	72 Å²	72	117.9 Å²	117.9	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-76	-28.8	175.5	53.9	0	0	0	0	113.6	D536 S537	D536-S540 WeakPolarHBondContact O-CB 3.2Å; D536-S540 PolarHBondContact O-N 2.82Å; D536-S540 PolarHBondContact O-OG 3.35Å; S537-S540 WeakPolarHBondContact CA-OG 3.3Å; S537-S540 PolarHBondContact O-OG 3.26Å; S537-S540 VanDerWaalsContact O-OG 3.12Å
541	N	54.8	Low	50.5	Low	143 Å²	143	119.4 Å²	119.4	77%	0.765	63%	0.633	S	S	*	*	H	α-helix	trans	-85.5	-8.1	176.7	-78	-31.1	0	0	0	114.5	S537	S537-N541 WeakPolarHBondContact O-CB 3.41Å; S537-N541 PolarHBondContact O-N 2.59Å; S537-N541 PolarHBondContact O-ND2 3.21Å
542	S	50.1	Low	50.7	Low	70 Å²	70	120.7 Å²	120.7	49%	0.49	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.5	29.7	179.4	51.4	0	0	0	0	114.1	E538 L539 V544	E538-S542 WeakPolarHBondContact O-CB 3.49Å; E538-S542 PolarHBondContact O-N 2.95Å; E538-S542 PolarHBondContact O-OG 2.7Å; L539-S542 PolarHBondContact O-OG 3.23Å; S542-V544 PolarHBondContact O-N 2.91Å
543	N	44.7	Very low	50.5	Low	151 Å²	151	123.2 Å²	123.2	81%	0.807	65%	0.653	S	S	*	*			trans	-69	61.6	161.3	-85	-41	0	0	0	111.2
544	V	42.4	Very low	50.2	Low	123 Å²	123	122.4 Å²	122.4	75%	0.745	66%	0.658	S	S	*	*			trans	-86.1	110.1	162.9	179	0	0	0	0	106.3	S542 L546	S542-V544 PolarHBondContact O-N 2.91Å; V544-L546 PolarHBondContact O-N 2.84Å
545	K	40.6	Very low	49.9	Very low	206 Å²	206	125.2 Å²	125.2	90%	0.896	68%	0.675	S	S	*	*			trans	-49.2	122.6	172.1	-71.7	176.5	175.3	177.9	0	110.4
546	L	42.3	Very low	49.8	Very low	244 Å²	244	128.1 Å²	128.1	100%	1.277	69%	0.692	S	S	*	*			trans	-122.9	0	149.7	-89.5	167.5	0	0	0	108.1	V544	V544-L546 PolarHBondContact O-N 2.84Å

Retrieved 546 of 546 residues in 500.2 ms (Link to these results)

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